H2 |
Hydrogen diatomic |
1 |
Σg |
4426 |
4161 |
0.940 |
1 |
1 |
Na2 |
Sodium diatomic |
1 |
Σg |
157 |
158 |
1.005 |
2 |
2 |
BeH |
beryllium monohydride |
1 |
Σ |
2058 |
1987 |
0.966 |
3 |
3 |
TiH |
Titanium monohydride |
1 |
Σ |
1541 |
1385 |
0.899 |
4 |
4 |
BH |
Boron monohydride |
1 |
Σ |
2375 |
2269 |
0.956 |
5 |
5 |
ScH |
Scandium monohydride |
1 |
Σ |
1648 |
1547 |
0.939 |
6 |
6 |
C2 |
Carbon diatomic |
1 |
Σg |
1845 |
1827 |
0.990 |
7 |
7 |
AlC |
Aluminum carbide |
1 |
Σ |
620 |
646 |
1.042 |
8 |
8 |
SiH |
Silylidyne |
1 |
Σ |
2033 |
1971 |
0.970 |
9 |
9 |
SiC |
silicon monocarbide |
1 |
Σ |
1039 |
953 |
0.917 |
10 |
10 |
GeH |
germylidene |
1 |
Σ |
1915 |
1760 |
0.919 |
11 |
11 |
SiGe |
Silicon Germanium |
1 |
Σ |
495 |
419 |
0.847 |
12 |
12 |
BN |
boron nitride |
1 |
Σ |
1504 |
1490 |
0.991 |
13 |
13 |
CN |
Cyano radical |
1 |
Σ |
2085 |
2042 |
0.979 |
14 |
14 |
N2 |
Nitrogen diatomic |
1 |
Σg |
2346 |
2330 |
0.993 |
15 |
15 |
|
|
1 |
Σg |
1775 |
1733 |
0.976 |
15 |
16 |
PH |
phosphorus monohydride |
1 |
Σ |
2372 |
2276 |
0.960 |
16 |
17 |
AlP |
Aluminum monophosphide |
1 |
Σ |
462 |
379 |
0.820 |
17 |
18 |
|
|
1 |
Σ |
462 |
457 |
0.989 |
17 |
19 |
|
|
1 |
Σ |
578 |
470 |
0.813 |
17 |
20 |
SiP |
Silicon monophosphide |
1 |
Σ |
651 |
611 |
0.939 |
18 |
21 |
P2 |
Phosphorus diatomic |
1 |
Σg |
759 |
775 |
1.022 |
19 |
22 |
GaP |
Gallium monophosphide |
1 |
Σ |
360 |
284 |
0.788 |
20 |
23 |
GaAs |
Gallium arsenide |
1 |
Σ |
213 |
209 |
0.982 |
21 |
24 |
OH |
Hydroxyl radical |
1 |
Σ |
3701 |
3570 |
0.965 |
22 |
25 |
LiO |
lithium oxide |
1 |
Σ |
851 |
799 |
0.939 |
23 |
26 |
BO |
boron monoxide |
1 |
Σ |
1855 |
1862 |
1.004 |
24 |
27 |
CO |
Carbon monoxide |
1 |
Σ |
2152 |
2143 |
0.996 |
25 |
28 |
NO |
Nitric oxide |
1 |
Σ |
1920 |
1876 |
0.977 |
26 |
29 |
O2 |
Oxygen diatomic |
1 |
Σg |
1546 |
1556 |
1.007 |
27 |
30 |
NaO |
sodium monoxide |
1 |
Σ |
507 |
|
|
28 |
31 |
PO |
Phosphorus monoxide |
1 |
Σ |
1146 |
1220 |
1.065 |
29 |
32 |
HS |
Mercapto radical |
1 |
Σ |
2708 |
2599 |
0.960 |
30 |
33 |
LiS |
Lithium monosulfide |
1 |
Σ |
575 |
|
|
31 |
34 |
NS |
Mononitrogen monosulfide |
1 |
Σ |
1512 |
1204 |
0.797 |
32 |
35 |
PS |
phosphorus sulfide |
1 |
Σ |
761 |
|
|
33 |
36 |
S2 |
Sulfur diatomic |
1 |
Σg |
695 |
720 |
1.036 |
34 |
37 |
CaS |
Calcium sulfide |
1 |
Σ |
458 |
459 |
1.001 |
35 |
38 |
ScO |
Scandium monoxide |
1 |
Σ |
972 |
957 |
0.984 |
36 |
39 |
TiO |
Titanium monoxide |
1 |
Σ |
1040 |
1000 |
0.961 |
37 |
40 |
VO |
Vanadium monoxide |
1 |
Σ |
1104 |
1002 |
0.908 |
38 |
41 |
CrH |
Chromium hydride |
1 |
Σ |
1641 |
1534 |
0.935 |
39 |
42 |
GeO |
Germanium monoxide |
1 |
Σ |
929 |
977 |
1.051 |
40 |
43 |
GeS |
Germanium monosulfide |
1 |
Σ |
563 |
576 |
1.023 |
41 |
44 |
NSe |
Nitrogen monoselenide |
1 |
Σ |
1142 |
946 |
0.828 |
42 |
45 |
SiSe |
Silicon Monoselenide |
1 |
Σ |
568 |
|
|
43 |
46 |
AsSe |
Arsenic monoselenide |
1 |
Σ |
556 |
280 |
0.503 |
44 |
47 |
HF |
Hydrogen fluoride |
1 |
Σ |
4096 |
3961 |
0.967 |
45 |
48 |
LiF |
lithium fluoride |
1 |
Σ |
986 |
896 |
0.909 |
46 |
49 |
BF |
Boron monofluoride |
1 |
Σ |
1339 |
1379 |
1.029 |
47 |
50 |
CF |
Fluoromethylidyne |
1 |
Σ |
1297 |
1286 |
0.992 |
48 |
51 |
FO |
Oxygen monofluoride |
1 |
Σ |
1090 |
1033 |
0.948 |
49 |
52 |
F2 |
Fluorine diatomic |
1 |
Σg |
965 |
894 |
0.927 |
50 |
53 |
NaF |
sodium fluoride |
1 |
Σ |
583 |
529 |
0.907 |
51 |
54 |
SiF |
silicon monofluoride |
1 |
Σ |
835 |
848 |
1.015 |
52 |
55 |
SF |
Monosulfur monofluoride |
1 |
Σ |
820 |
829 |
1.011 |
53 |
56 |
LiCl |
lithium chloride |
1 |
Σ |
631 |
634 |
1.005 |
54 |
57 |
NCl |
nitrogen monochloride |
1 |
Σ |
811 |
817 |
1.008 |
55 |
58 |
ClF |
Chlorine monofluoride |
1 |
Σ |
759 |
773 |
1.019 |
56 |
59 |
NaCl |
Sodium Chloride |
1 |
Σ |
358 |
361 |
1.009 |
57 |
60 |
AlCl |
Aluminum monochloride |
1 |
Σ |
462 |
478 |
1.034 |
58 |
61 |
SCl |
sulfur monochloride |
1 |
Σ |
557 |
577 |
1.036 |
59 |
62 |
Cl2 |
Chlorine diatomic |
1 |
Σg |
532 |
554 |
1.043 |
60 |
63 |
ScF |
Scandium monofluoride |
1 |
Σ |
752 |
728 |
0.968 |
61 |
64 |
ZnF |
Zinc monofluoride |
1 |
Σ |
633 |
616 |
0.973 |
62 |
65 |
AsF |
Arsenic monofluoride |
1 |
Σ |
694 |
|
|
63 |
66 |
AsCl |
Arsenic monochloride |
1 |
Σ |
417 |
439 |
1.053 |
64 |
67 |
SeF |
Selenium monofluoride |
1 |
Σ |
693 |
685 |
0.989 |
65 |
68 |
HBr |
hydrogen bromide |
1 |
Σ |
2676 |
2559 |
0.956 |
66 |
69 |
CBr |
Carbon monobromide |
1 |
Σ |
721 |
720 |
0.998 |
67 |
70 |
BrO |
Bromine monoxide |
1 |
Σ |
695 |
716 |
1.030 |
68 |
71 |
AlBr |
Aluminum monobromide |
1 |
Σ |
366 |
375 |
1.025 |
69 |
72 |
SiBr |
Silicon monobromide |
1 |
Σ |
411 |
421 |
1.024 |
70 |
73 |
PBr |
Phosphorus monobromide |
1 |
Σ |
425 |
|
|
71 |
74 |
CaBr |
Calcium monobromide |
1 |
Σ |
281 |
284 |
1.010 |
72 |
75 |
Li3 |
Lithium trimer |
1 |
A1 |
322 |
302 |
0.937 |
73 |
76 |
CH2 |
Methylene |
1 |
A1 |
3158 |
2806 |
0.889 |
74 |
77 |
|
|
1 |
A1 |
2931 |
2806 |
0.957 |
74 |
78 |
|
|
2 |
A1 |
1416 |
1353 |
0.955 |
74 |
79 |
|
|
2 |
A1 |
1098 |
963 |
0.878 |
74 |
80 |
|
|
3 |
B2 |
3401 |
3190 |
0.938 |
74 |
81 |
|
|
3 |
B2 |
3005 |
2865 |
0.953 |
74 |
82 |
C2H |
Ethynyl radical |
1 |
Σ |
3493 |
3299 |
0.944 |
75 |
83 |
|
|
2 |
Σ |
2119 |
1841 |
0.869 |
75 |
84 |
|
|
3 |
Π |
269 |
372 |
1.384 |
75 |
85 |
GeH2 |
germylene |
1 |
A1 |
1934 |
1856 |
0.960 |
76 |
86 |
|
|
2 |
A1 |
957 |
916 |
0.957 |
76 |
87 |
|
|
3 |
B2 |
1939 |
1863 |
0.960 |
76 |
88 |
NH2 |
Amino radical |
1 |
A1 |
3348 |
3219 |
0.962 |
77 |
89 |
|
|
2 |
A1 |
1563 |
1497 |
0.958 |
77 |
90 |
|
|
3 |
B2 |
3443 |
3301 |
0.959 |
77 |
91 |
N3 |
azide radical |
3 |
Πu |
581 |
457 |
0.786 |
78 |
92 |
H2O |
Water |
1 |
A1 |
3804 |
3657 |
0.961 |
79 |
93 |
|
|
2 |
A1 |
1674 |
1595 |
0.953 |
79 |
94 |
|
|
3 |
B2 |
3912 |
3756 |
0.960 |
79 |
95 |
HDO |
Water-d1 |
1 |
A' |
3860 |
3707 |
0.960 |
80 |
96 |
|
|
2 |
A' |
2802 |
2727 |
0.973 |
80 |
97 |
|
|
3 |
A' |
1466 |
1402 |
0.956 |
80 |
98 |
Li2O |
dilithium oxide |
1 |
Σg |
775 |
779 |
1.005 |
81 |
99 |
|
|
2 |
Σu |
1041 |
964 |
0.926 |
81 |
100 |
|
|
3 |
Πu |
126 |
112 |
0.888 |
81 |
101 |
HBO |
Boron hydride oxide |
1 |
Σ |
2922 |
2850 |
0.976 |
82 |
102 |
|
|
2 |
Σ |
1825 |
1826 |
1.000 |
82 |
103 |
|
|
3 |
Π |
808 |
756 |
0.936 |
82 |
104 |
HO2 |
Hydroperoxy radical |
1 |
A' |
3611 |
3436 |
0.952 |
83 |
105 |
|
|
2 |
A' |
1424 |
1392 |
0.977 |
83 |
106 |
|
|
3 |
A' |
1171 |
1098 |
0.937 |
83 |
107 |
CCO |
Dicarbon monoxide |
1 |
Σ |
2024 |
1971 |
0.974 |
84 |
108 |
|
|
1 |
Σ |
2003 |
1943 |
0.970 |
84 |
109 |
|
|
2 |
Σ |
1083 |
1067 |
0.985 |
84 |
110 |
NCO |
isocyanato radical |
1 |
Σ |
2041 |
1921 |
0.941 |
85 |
111 |
|
|
2 |
Σ |
1273 |
1267 |
0.995 |
85 |
112 |
|
|
3 |
Π |
572 |
535 |
0.936 |
85 |
113 |
CO2 |
Carbon dioxide |
1 |
Σg |
1338 |
1333 |
0.996 |
86 |
114 |
|
|
2 |
Σu |
2412 |
2349 |
0.974 |
86 |
115 |
|
|
3 |
Πu |
650 |
667 |
1.026 |
86 |
116 |
N2O |
Nitrous oxide |
1 |
Σ |
2288 |
2224 |
0.972 |
87 |
117 |
|
|
2 |
Σ |
1320 |
1285 |
0.973 |
87 |
118 |
|
|
3 |
Π |
591 |
589 |
0.996 |
87 |
119 |
NO2 |
Nitrogen dioxide |
1 |
A1 |
1354 |
1318 |
0.973 |
88 |
120 |
|
|
2 |
A1 |
752 |
750 |
0.997 |
88 |
121 |
|
|
3 |
B2 |
1732 |
1618 |
0.934 |
88 |
122 |
O3 |
Ozone |
1 |
A1 |
1131 |
1110 |
0.981 |
89 |
123 |
|
|
2 |
A1 |
707 |
705 |
0.997 |
89 |
124 |
|
|
3 |
B2 |
1180 |
1042 |
0.883 |
89 |
125 |
SiS2 |
Silicon disulfide |
1 |
Σg |
506 |
514 |
1.016 |
90 |
126 |
S3 |
Sulfur trimer |
2 |
A1 |
565 |
281 |
0.498 |
91 |
127 |
TiO2 |
Titanium dioxide |
1 |
A1 |
934 |
959 |
1.027 |
92 |
128 |
|
|
2 |
A1 |
332 |
323 |
0.973 |
92 |
129 |
|
|
3 |
B2 |
939 |
944 |
1.006 |
92 |
130 |
H2Se |
Hydrogen selenide |
1 |
A1 |
2452 |
2345 |
0.956 |
93 |
131 |
|
|
2 |
A1 |
1076 |
1034 |
0.961 |
93 |
132 |
|
|
3 |
B2 |
2469 |
2358 |
0.955 |
93 |
133 |
SeO2 |
Selenium dioxide |
1 |
A1 |
867 |
922 |
1.063 |
94 |
134 |
|
|
2 |
A1 |
345 |
373 |
1.079 |
94 |
135 |
|
|
3 |
B2 |
929 |
966 |
1.040 |
94 |
136 |
SCSe |
Carbon sulfide selenide |
1 |
Σ |
1470 |
1435 |
0.976 |
95 |
137 |
|
|
2 |
Σ |
514 |
506 |
0.984 |
95 |
138 |
|
|
3 |
Π |
354 |
355 |
1.004 |
95 |
139 |
CSe2 |
Carbon diselenide |
1 |
Σg |
375 |
369 |
0.983 |
96 |
140 |
|
|
2 |
Σu |
1341 |
1302 |
0.971 |
96 |
141 |
CNF |
iso cyanogen fluoride |
1 |
Σ |
2154 |
2123 |
0.986 |
97 |
142 |
|
|
2 |
Σ |
957 |
928 |
0.970 |
97 |
143 |
FCO |
Carbonyl fluoride |
1 |
A' |
1897 |
1862 |
0.981 |
98 |
144 |
|
|
2 |
A' |
1050 |
1026 |
0.977 |
98 |
145 |
|
|
3 |
A' |
625 |
628 |
1.004 |
98 |
146 |
BF2 |
Boron difluoride radical |
1 |
A1 |
1132 |
1153 |
1.019 |
99 |
147 |
|
|
2 |
A1 |
515 |
525 |
1.019 |
99 |
148 |
|
|
3 |
B2 |
1396 |
1394 |
0.998 |
99 |
149 |
CF2 |
Difluoromethylene |
1 |
A1 |
1238 |
1225 |
0.989 |
100 |
150 |
|
|
2 |
A1 |
665 |
667 |
1.004 |
100 |
151 |
|
|
3 |
B2 |
1142 |
1114 |
0.976 |
100 |
152 |
FSN |
Thiazyl fluoride |
1 |
A' |
1377 |
1372 |
0.996 |
101 |
153 |
|
|
2 |
A' |
637 |
640 |
1.005 |
101 |
154 |
|
|
3 |
A' |
343 |
366 |
1.069 |
101 |
155 |
SFCl |
Sulfur chloride fluoride |
1 |
A' |
779 |
781 |
1.003 |
102 |
156 |
|
|
2 |
A' |
530 |
552 |
1.041 |
102 |
157 |
|
|
3 |
A' |
254 |
277 |
1.090 |
102 |
158 |
ClCO |
carbonyl monochloride |
1 |
A' |
1918 |
1885 |
0.982 |
103 |
159 |
|
|
2 |
A' |
589 |
570 |
0.968 |
103 |
160 |
|
|
3 |
A' |
336 |
335 |
0.996 |
103 |
161 |
CFCl |
chlorofluoromethylene |
1 |
A' |
1189 |
1154 |
0.970 |
104 |
162 |
|
|
2 |
A' |
749 |
753 |
1.006 |
104 |
163 |
|
|
3 |
A' |
441 |
447 |
1.013 |
104 |
164 |
OPCl |
Phosphorus oxychloride |
1 |
A' |
1198 |
1263 |
1.054 |
105 |
165 |
|
|
2 |
A' |
483 |
308 |
0.638 |
105 |
166 |
|
|
3 |
A' |
292 |
492 |
1.682 |
105 |
167 |
ClSO |
Sulfur chloride oxide |
1 |
A' |
1162 |
1163 |
1.001 |
106 |
168 |
HOBr |
Hypobromous acid |
1 |
A' |
3751 |
3615 |
0.964 |
107 |
169 |
|
|
2 |
A' |
1176 |
1163 |
0.988 |
107 |
170 |
|
|
3 |
A' |
621 |
620 |
0.999 |
107 |
171 |
CBr2 |
dibromomethylene |
1 |
A1 |
603 |
598 |
0.992 |
108 |
172 |
|
|
2 |
A1 |
196 |
194 |
0.990 |
108 |
173 |
|
|
3 |
B2 |
641 |
660 |
1.030 |
108 |
174 |
AlH3 |
aluminum trihydride |
1 |
A1' |
1925 |
1900 |
0.987 |
109 |
175 |
|
|
2 |
A2" |
722 |
698 |
0.966 |
109 |
176 |
|
|
3 |
E' |
1934 |
1883 |
0.974 |
109 |
177 |
|
|
4 |
E' |
803 |
783 |
0.976 |
109 |
178 |
CH3 |
Methyl radical |
1 |
A1' |
3140 |
3004 |
0.957 |
110 |
179 |
|
|
2 |
A2" |
442 |
606 |
1.373 |
110 |
180 |
|
|
3 |
E' |
3337 |
3161 |
0.947 |
110 |
181 |
|
|
4 |
E' |
1400 |
1396 |
0.997 |
110 |
182 |
SiH3 |
Silyl radical |
1 |
A1 |
2210 |
2136 |
0.966 |
111 |
183 |
|
|
2 |
A1 |
775 |
728 |
0.939 |
111 |
184 |
|
|
3 |
E |
2250 |
2185 |
0.971 |
111 |
185 |
|
|
4 |
E |
942 |
922 |
0.979 |
111 |
186 |
NH3 |
Ammonia |
1 |
A1 |
3456 |
3337 |
0.966 |
112 |
187 |
|
|
2 |
A1 |
1143 |
950 |
0.831 |
112 |
188 |
|
|
3 |
E |
3580 |
3444 |
0.962 |
112 |
189 |
|
|
4 |
E |
1688 |
1627 |
0.964 |
112 |
190 |
HBNH |
Boranimine |
1 |
Σ |
3878 |
3711 |
0.957 |
113 |
191 |
|
|
2 |
Σ |
2907 |
2775 |
0.955 |
113 |
192 |
|
|
3 |
Σ |
1818 |
1786 |
0.983 |
113 |
193 |
|
|
4 |
Π |
731 |
677 |
0.926 |
113 |
194 |
|
|
5 |
Π |
449 |
461 |
1.026 |
113 |
195 |
N2H2 |
(E)-diazene |
1 |
Ag |
3226 |
3058 |
0.948 |
114 |
196 |
|
|
2 |
Ag |
1628 |
1583 |
0.972 |
114 |
197 |
|
|
3 |
Ag |
1593 |
1529 |
0.960 |
114 |
198 |
|
|
4 |
Au |
1344 |
1289 |
0.959 |
114 |
199 |
|
|
5 |
Bu |
3255 |
3120 |
0.959 |
114 |
200 |
|
|
6 |
Bu |
1351 |
1316 |
0.974 |
114 |
201 |
HCCN |
cyanomethylene |
1 |
Σ |
3464 |
3247 |
0.937 |
115 |
202 |
|
|
2 |
Σ |
1718 |
1735 |
1.010 |
115 |
203 |
|
|
3 |
Σ |
1266 |
1179 |
0.931 |
115 |
204 |
|
|
4 |
Π |
454 |
383 |
0.843 |
115 |
205 |
|
|
5 |
Π |
340i |
129 |
-0.379 |
115 |
206 |
C2N2 |
Cyanogen |
1 |
Σg |
2357 |
2330 |
0.989 |
116 |
207 |
|
|
2 |
Σg |
880 |
846 |
0.961 |
116 |
208 |
|
|
3 |
Σu |
2173 |
2158 |
0.993 |
116 |
209 |
|
|
4 |
Πg |
539 |
503 |
0.932 |
116 |
210 |
|
|
5 |
Πu |
249 |
234 |
0.940 |
116 |
211 |
PH3 |
Phosphine |
1 |
A1 |
2421 |
2323 |
0.960 |
117 |
212 |
|
|
2 |
A1 |
1028 |
992 |
0.965 |
117 |
213 |
|
|
3 |
E |
2434 |
2328 |
0.956 |
117 |
214 |
|
|
4 |
E |
1143 |
1118 |
0.978 |
117 |
215 |
AsH3 |
Arsine |
1 |
A1 |
2232 |
2116 |
0.948 |
118 |
216 |
|
|
2 |
A1 |
954 |
906 |
0.950 |
118 |
217 |
|
|
3 |
E |
2247 |
2123 |
0.945 |
118 |
218 |
|
|
4 |
E |
1033 |
1003 |
0.971 |
118 |
219 |
H2CO |
Formaldehyde |
1 |
A1 |
2917 |
2782 |
0.954 |
119 |
220 |
|
|
2 |
A1 |
1809 |
1746 |
0.965 |
119 |
221 |
|
|
3 |
A1 |
1532 |
1500 |
0.979 |
119 |
222 |
|
|
4 |
B1 |
1195 |
1167 |
0.976 |
119 |
223 |
|
|
5 |
B2 |
2976 |
2843 |
0.955 |
119 |
224 |
|
|
6 |
B2 |
1264 |
1249 |
0.988 |
119 |
225 |
H2O2 |
Hydrogen peroxide |
1 |
A |
3764 |
3599 |
0.956 |
120 |
226 |
|
|
2 |
A |
1444 |
1402 |
0.971 |
120 |
227 |
|
|
3 |
A |
929 |
877 |
0.944 |
120 |
228 |
|
|
4 |
A |
334 |
371 |
1.111 |
120 |
229 |
|
|
5 |
B |
3762 |
3608 |
0.959 |
120 |
230 |
|
|
6 |
B |
1302 |
1266 |
0.973 |
120 |
231 |
HCNO |
fulminic acid |
1 |
Σ |
3535 |
3336 |
0.944 |
121 |
232 |
|
|
2 |
Σ |
2301 |
2196 |
0.954 |
121 |
233 |
|
|
3 |
Σ |
1303 |
1254 |
0.962 |
121 |
234 |
|
|
4 |
Π |
560 |
537 |
0.958 |
121 |
235 |
|
|
5 |
Π |
266i |
224 |
-0.844 |
121 |
236 |
HOCO |
Hydrocarboxyl radical |
1 |
A' |
3800 |
3636 |
0.957 |
122 |
237 |
|
|
1 |
A' |
3605 |
3316 |
0.920 |
122 |
238 |
|
|
2 |
A' |
1860 |
1797 |
0.966 |
122 |
239 |
|
|
2 |
A' |
1892 |
1853 |
0.979 |
122 |
240 |
|
|
3 |
A' |
1258 |
1210 |
0.962 |
122 |
241 |
|
|
3 |
A' |
1317 |
1261 |
0.958 |
122 |
242 |
|
|
4 |
A' |
1094 |
1088 |
0.994 |
122 |
243 |
|
|
4 |
A' |
1099 |
1050 |
0.956 |
122 |
244 |
|
|
5 |
A' |
602 |
620 |
1.030 |
122 |
245 |
|
|
6 |
A" |
544 |
508 |
0.933 |
122 |
246 |
C3O |
Tricarbon monoxide |
1 |
Σ |
2324 |
2257 |
0.971 |
123 |
247 |
|
|
2 |
Σ |
1933 |
1907 |
0.986 |
123 |
248 |
|
|
3 |
Σ |
953 |
935 |
0.981 |
123 |
249 |
|
|
4 |
Π |
600 |
581 |
0.969 |
123 |
250 |
|
|
5 |
Π |
179 |
109 |
0.609 |
123 |
251 |
ONNO |
NO dimer |
1 |
A1 |
1880 |
1868 |
0.994 |
124 |
252 |
|
|
2 |
A1 |
375 |
239 |
0.638 |
124 |
253 |
|
|
3 |
A1 |
325 |
135 |
0.414 |
124 |
254 |
|
|
4 |
A2 |
261 |
117 |
0.449 |
124 |
255 |
|
|
5 |
B2 |
1742 |
1789 |
1.027 |
124 |
256 |
|
|
6 |
B2 |
687 |
429 |
0.625 |
124 |
257 |
H2CS |
Thioformaldehyde |
1 |
A1 |
3091 |
2971 |
0.961 |
125 |
258 |
|
|
2 |
A1 |
1483 |
1456 |
0.981 |
125 |
259 |
|
|
3 |
A1 |
1084 |
1059 |
0.977 |
125 |
260 |
|
|
4 |
B1 |
1013 |
990 |
0.977 |
125 |
261 |
|
|
5 |
B2 |
3184 |
3025 |
0.950 |
125 |
262 |
|
|
6 |
B2 |
1000 |
991 |
0.991 |
125 |
263 |
HOSH |
hydrogen thioperoxide |
1 |
A |
3777 |
3626 |
0.960 |
126 |
264 |
|
|
2 |
A |
2644 |
2538 |
0.960 |
126 |
265 |
|
|
3 |
A |
1199 |
1176 |
0.981 |
126 |
266 |
|
|
5 |
A |
751 |
763 |
1.015 |
126 |
267 |
|
|
6 |
A |
470 |
445 |
0.947 |
126 |
268 |
HSCN |
thiocyanic acid |
1 |
A' |
2703 |
2581 |
0.955 |
127 |
269 |
|
|
2 |
A' |
2219 |
2182 |
0.983 |
127 |
270 |
|
|
3 |
A' |
972 |
960 |
0.988 |
127 |
271 |
HNCS |
Isothiocyanic acid |
1 |
A' |
3664 |
3539 |
0.966 |
128 |
272 |
|
|
2 |
A' |
2033 |
1989 |
0.978 |
128 |
273 |
|
|
3 |
A' |
878 |
857 |
0.976 |
128 |
274 |
|
|
4 |
A' |
687 |
615 |
0.895 |
128 |
275 |
|
|
5 |
A' |
447 |
469 |
1.049 |
128 |
276 |
|
|
6 |
A" |
476 |
539 |
1.132 |
128 |
277 |
H2S2 |
Disulfane |
1 |
A |
2671 |
2556 |
0.957 |
129 |
278 |
|
|
2 |
A |
885 |
882 |
0.996 |
129 |
279 |
|
|
3 |
A |
506 |
515 |
1.017 |
129 |
280 |
|
|
4 |
A |
420 |
417 |
0.995 |
129 |
281 |
|
|
5 |
B |
2674 |
2559 |
0.957 |
129 |
282 |
|
|
6 |
B |
888 |
878 |
0.989 |
129 |
283 |
S2N2 |
Disulfur dinitride |
1 |
Ag |
856 |
913 |
1.067 |
130 |
284 |
|
|
2 |
Ag |
609 |
632 |
1.038 |
130 |
285 |
|
|
3 |
B1u |
651 |
656 |
1.007 |
130 |
286 |
|
|
4 |
B2u |
722 |
790 |
1.093 |
130 |
287 |
|
|
5 |
B3g |
886 |
898 |
1.014 |
130 |
288 |
|
|
6 |
B3u |
445 |
474 |
1.064 |
130 |
289 |
NHF2 |
difluoramine |
1 |
A' |
3384 |
3193 |
0.944 |
131 |
290 |
|
|
2 |
A' |
1330 |
1307 |
0.983 |
131 |
291 |
|
|
3 |
A' |
989 |
972 |
0.983 |
131 |
292 |
|
|
4 |
A' |
499 |
500 |
1.002 |
131 |
293 |
|
|
5 |
A" |
1461 |
1424 |
0.974 |
131 |
294 |
|
|
6 |
A" |
893 |
888 |
0.994 |
131 |
295 |
SiF3 |
Silicon trifluoride radical |
1 |
A1 |
803 |
835 |
1.040 |
132 |
296 |
|
|
2 |
A1 |
377 |
406 |
1.076 |
132 |
297 |
|
|
3 |
E |
941 |
959 |
1.019 |
132 |
298 |
|
|
4 |
E |
265 |
290 |
1.095 |
132 |
299 |
HCCCl |
Chloroacetylene |
1 |
Σ |
3508 |
3340 |
0.952 |
133 |
300 |
|
|
2 |
Σ |
2175 |
2110 |
0.970 |
133 |
301 |
|
|
3 |
Σ |
760 |
756 |
0.994 |
133 |
302 |
|
|
4 |
Π |
628 |
604 |
0.962 |
133 |
303 |
|
|
5 |
Π |
328 |
326 |
0.994 |
133 |
304 |
ClONO |
chlorine nitrite |
1 |
A' |
1721 |
1715 |
0.997 |
134 |
305 |
|
|
2 |
A' |
866 |
858 |
0.991 |
134 |
306 |
|
|
3 |
A' |
637 |
644 |
1.011 |
134 |
307 |
|
|
4 |
A' |
361 |
406 |
1.124 |
134 |
308 |
|
|
5 |
A' |
232 |
270 |
1.166 |
134 |
309 |
ClF3 |
Chlorine trifluoride |
1 |
A1 |
707 |
752 |
1.063 |
135 |
310 |
|
|
2 |
A1 |
512 |
529 |
1.033 |
135 |
311 |
|
|
3 |
A1 |
287 |
328 |
1.142 |
135 |
312 |
|
|
4 |
B1 |
310 |
328 |
1.059 |
135 |
313 |
|
|
5 |
B2 |
736 |
702 |
0.954 |
135 |
314 |
|
|
6 |
B2 |
383 |
442 |
1.154 |
135 |
315 |
ClOOCl |
Dichlorine dioxide |
1 |
A |
891 |
750 |
0.842 |
136 |
316 |
|
|
2 |
A |
516 |
560 |
1.085 |
136 |
317 |
|
|
5 |
B |
596 |
653 |
1.096 |
136 |
318 |
|
|
6 |
B |
404 |
419 |
1.035 |
136 |
319 |
NCl3 |
nitrogen trichloride |
1 |
A1 |
546 |
538 |
0.985 |
137 |
320 |
|
|
2 |
A1 |
349 |
349 |
0.999 |
137 |
321 |
|
|
3 |
E |
617 |
642 |
1.040 |
137 |
322 |
|
|
4 |
E |
255 |
257 |
1.007 |
137 |
323 |
AsCl3 |
Arsenous trichloride |
1 |
A1 |
412 |
|
|
138 |
324 |
|
|
2 |
A1 |
190 |
|
|
138 |
325 |
|
|
3 |
E |
390 |
|
|
138 |
326 |
|
|
4 |
E |
148 |
|
|
138 |
327 |
HCCBr |
bromoacetylene |
1 |
Σ |
3501 |
3325 |
0.950 |
139 |
328 |
|
|
2 |
Σ |
2146 |
2085 |
0.971 |
139 |
329 |
|
|
3 |
Σ |
609 |
618 |
1.015 |
139 |
330 |
|
|
4 |
Π |
629 |
618 |
0.982 |
139 |
331 |
|
|
5 |
Π |
294 |
295 |
1.003 |
139 |
332 |
CH4 |
Methane |
1 |
A1 |
3059 |
2917 |
0.954 |
140 |
333 |
|
|
2 |
E |
1552 |
1534 |
0.988 |
140 |
334 |
|
|
3 |
T2 |
3190 |
3019 |
0.946 |
140 |
335 |
|
|
4 |
T2 |
1329 |
1306 |
0.983 |
140 |
336 |
CH3Li |
methyl lithium |
1 |
A1 |
2992 |
2780 |
0.929 |
141 |
337 |
|
|
2 |
A1 |
1085 |
1158 |
1.067 |
141 |
338 |
|
|
3 |
A1 |
621 |
530 |
0.854 |
141 |
339 |
|
|
4 |
E |
3065 |
2820 |
0.920 |
141 |
340 |
|
|
5 |
E |
1440 |
1387 |
0.963 |
141 |
341 |
|
|
6 |
E |
438 |
409 |
0.932 |
141 |
342 |
C2H3 |
vinyl |
1 |
A' |
3272 |
3141 |
0.960 |
142 |
343 |
|
|
2 |
A' |
3202 |
2953 |
0.922 |
142 |
344 |
|
|
3 |
A' |
3092 |
2912 |
0.942 |
142 |
345 |
|
|
5 |
A' |
1384 |
1360 |
0.983 |
142 |
346 |
|
|
7 |
A' |
717 |
674 |
0.940 |
142 |
347 |
|
|
8 |
A" |
922 |
895 |
0.971 |
142 |
348 |
|
|
9 |
A" |
814 |
857 |
1.053 |
142 |
349 |
SiH4 |
Silane |
1 |
A1 |
2246 |
2187 |
0.974 |
143 |
350 |
|
|
2 |
E |
986 |
975 |
0.988 |
143 |
351 |
|
|
3 |
T2 |
2257 |
2191 |
0.971 |
143 |
352 |
|
|
4 |
T2 |
927 |
914 |
0.986 |
143 |
353 |
SiH2D2 |
silane-d2 |
1 |
A1 |
2249 |
2189 |
0.973 |
144 |
354 |
|
|
2 |
A1 |
1608 |
1587 |
0.987 |
144 |
355 |
|
|
3 |
A1 |
957 |
944 |
0.986 |
144 |
356 |
|
|
4 |
A1 |
689 |
683 |
0.992 |
144 |
357 |
|
|
5 |
A2 |
854 |
844 |
0.988 |
144 |
358 |
|
|
6 |
B1 |
1629 |
2183 |
1.340 |
144 |
359 |
|
|
7 |
B1 |
871 |
743 |
0.853 |
144 |
360 |
|
|
8 |
B2 |
2254 |
1601 |
0.710 |
144 |
361 |
|
|
9 |
B2 |
751 |
862 |
1.148 |
144 |
362 |
GeH4 |
Germane |
1 |
A1 |
2174 |
2106 |
0.969 |
145 |
363 |
|
|
2 |
E |
939 |
931 |
0.991 |
145 |
364 |
|
|
3 |
T2 |
2175 |
2114 |
0.972 |
145 |
365 |
|
|
4 |
T2 |
840 |
819 |
0.975 |
145 |
366 |
CH2OH |
Hydroxymethyl radical |
1 |
A |
3831 |
3650 |
0.953 |
146 |
367 |
|
|
4 |
A |
1487 |
1459 |
0.981 |
146 |
368 |
|
|
5 |
A |
1378 |
1334 |
0.968 |
146 |
369 |
|
|
6 |
A |
1226 |
1176 |
0.959 |
146 |
370 |
|
|
7 |
A |
1063 |
1048 |
0.986 |
146 |
371 |
|
|
8 |
A |
659 |
482 |
0.731 |
146 |
372 |
|
|
9 |
A |
458 |
234 |
0.511 |
146 |
373 |
NH2OH |
hydroxylamine |
1 |
A' |
3810 |
3650 |
0.958 |
147 |
374 |
|
|
2 |
A' |
3434 |
3294 |
0.959 |
147 |
375 |
|
|
3 |
A' |
1671 |
1605 |
0.960 |
147 |
376 |
|
|
4 |
A' |
1414 |
1353 |
0.957 |
147 |
377 |
|
|
5 |
A' |
1172 |
1115 |
0.952 |
147 |
378 |
|
|
6 |
A' |
935 |
895 |
0.958 |
147 |
379 |
|
|
7 |
A" |
3516 |
3359 |
0.955 |
147 |
380 |
|
|
8 |
A" |
1337 |
1295 |
0.968 |
147 |
381 |
|
|
9 |
A" |
381 |
386 |
1.013 |
147 |
382 |
Be(OH)2 |
Beryllium hydroxide |
1 |
A |
3942 |
3806 |
0.965 |
148 |
383 |
|
|
7 |
B |
1532 |
1494 |
0.975 |
148 |
384 |
|
|
8 |
B |
592 |
456 |
0.770 |
148 |
385 |
HCOOH |
Formic acid |
1 |
A' |
3720 |
3570 |
0.960 |
149 |
386 |
|
|
2 |
A' |
3085 |
2943 |
0.954 |
149 |
387 |
|
|
3 |
A' |
1836 |
1770 |
0.964 |
149 |
388 |
|
|
4 |
A' |
1408 |
1387 |
0.985 |
149 |
389 |
|
|
5 |
A' |
1324 |
1229 |
0.929 |
149 |
390 |
|
|
6 |
A' |
1146 |
1105 |
0.964 |
149 |
391 |
|
|
7 |
A' |
629 |
625 |
0.993 |
149 |
392 |
|
|
8 |
A" |
1056 |
1033 |
0.978 |
149 |
393 |
|
|
9 |
A" |
704 |
638 |
0.906 |
149 |
394 |
HSSSH |
trisulfane |
1 |
A' |
2666 |
2548 |
0.956 |
150 |
395 |
|
|
2 |
A' |
876 |
865 |
0.988 |
150 |
396 |
|
|
3 |
A' |
483 |
480 |
0.993 |
150 |
397 |
|
|
5 |
A' |
202 |
240 |
1.191 |
150 |
398 |
|
|
6 |
A" |
2668 |
2548 |
0.955 |
150 |
399 |
|
|
7 |
A" |
863 |
865 |
1.002 |
150 |
400 |
|
|
8 |
A" |
468 |
480 |
1.025 |
150 |
401 |
CD3F |
methylfluoride-d3 |
1 |
A1 |
2188 |
2110 |
0.964 |
151 |
402 |
|
|
2 |
A1 |
1173 |
1136 |
0.969 |
151 |
403 |
|
|
3 |
A1 |
1009 |
991 |
0.982 |
151 |
404 |
|
|
4 |
E |
2337 |
2258 |
0.966 |
151 |
405 |
|
|
6 |
E |
1076 |
1072 |
0.996 |
151 |
406 |
|
|
8 |
E |
919 |
903 |
0.983 |
151 |
407 |
CH3F |
Methyl fluoride |
1 |
A1 |
3056 |
2930 |
0.959 |
152 |
408 |
|
|
2 |
A1 |
1493 |
1464 |
0.981 |
152 |
409 |
|
|
3 |
A1 |
1084 |
1049 |
0.968 |
152 |
410 |
|
|
4 |
E |
3148 |
3006 |
0.955 |
152 |
411 |
|
|
5 |
E |
1486 |
1467 |
0.987 |
152 |
412 |
|
|
6 |
E |
1194 |
1182 |
0.990 |
152 |
413 |
CH3Cl |
Methyl chloride |
1 |
A1 |
3098 |
2966 |
0.957 |
153 |
414 |
|
|
2 |
A1 |
1372 |
1355 |
0.987 |
153 |
415 |
|
|
3 |
A1 |
738 |
732 |
0.992 |
153 |
416 |
|
|
4 |
E |
3213 |
3042 |
0.947 |
153 |
417 |
|
|
5 |
E |
1473 |
1455 |
0.987 |
153 |
418 |
|
|
6 |
E |
1024 |
1015 |
0.991 |
153 |
419 |
SiH2Cl2 |
dichlorosilane |
1 |
A1 |
2285 |
2224 |
0.973 |
154 |
420 |
|
|
2 |
A1 |
955 |
954 |
0.999 |
154 |
421 |
|
|
3 |
A1 |
519 |
527 |
1.016 |
154 |
422 |
|
|
4 |
A1 |
184 |
188 |
1.024 |
154 |
423 |
|
|
5 |
A2 |
714 |
710 |
0.995 |
154 |
424 |
|
|
6 |
B1 |
2304 |
2237 |
0.971 |
154 |
425 |
|
|
7 |
B1 |
593 |
602 |
1.014 |
154 |
426 |
|
|
8 |
B2 |
884 |
876 |
0.990 |
154 |
427 |
|
|
9 |
B2 |
581 |
590 |
1.015 |
154 |
428 |
ClOF3 |
Chlorine trifluoride oxide |
1 |
A' |
1166 |
1222 |
1.048 |
155 |
429 |
|
|
2 |
A' |
640 |
694 |
1.085 |
155 |
430 |
|
|
3 |
A' |
475 |
489 |
1.030 |
155 |
431 |
|
|
4 |
A' |
419 |
482 |
1.150 |
155 |
432 |
|
|
5 |
A' |
274 |
319 |
1.165 |
155 |
433 |
|
|
6 |
A' |
190 |
224 |
1.179 |
155 |
434 |
|
|
7 |
A" |
730 |
676 |
0.926 |
155 |
435 |
|
|
8 |
A" |
451 |
499 |
1.107 |
155 |
436 |
|
|
9 |
A" |
349 |
412 |
1.181 |
155 |
437 |
CHCl3 |
Chloroform |
1 |
A1 |
3200 |
3034 |
0.948 |
156 |
438 |
|
|
2 |
A1 |
672 |
680 |
1.012 |
156 |
439 |
|
|
3 |
A1 |
368 |
366 |
0.995 |
156 |
440 |
|
|
4 |
E |
1233 |
1220 |
0.989 |
156 |
441 |
|
|
5 |
E |
766 |
774 |
1.011 |
156 |
442 |
|
|
6 |
E |
263 |
260 |
0.990 |
156 |
443 |
CCl4 |
Carbon tetrachloride |
1 |
A1 |
458 |
459 |
1.003 |
157 |
444 |
|
|
2 |
E |
220 |
217 |
0.984 |
157 |
445 |
|
|
3 |
T2 |
778 |
776 |
0.998 |
157 |
446 |
|
|
4 |
T2 |
317 |
314 |
0.989 |
157 |
447 |
CH2BrF |
Methane, bromofluoro- |
1 |
A' |
3121 |
2992 |
0.959 |
158 |
448 |
|
|
2 |
A' |
1492 |
1465 |
0.982 |
158 |
449 |
|
|
3 |
A' |
1333 |
1314 |
0.986 |
158 |
450 |
|
|
4 |
A' |
1110 |
1068 |
0.962 |
158 |
451 |
|
|
5 |
A' |
637 |
651 |
1.021 |
158 |
452 |
|
|
6 |
A' |
310 |
311 |
1.004 |
158 |
453 |
|
|
7 |
A" |
3211 |
3047 |
0.949 |
158 |
454 |
|
|
8 |
A" |
1247 |
1226 |
0.983 |
158 |
455 |
|
|
9 |
A" |
940 |
935 |
0.995 |
158 |
456 |
SiH3Br |
bromosilane |
1 |
A1 |
2256 |
2200 |
0.975 |
159 |
457 |
|
|
2 |
A1 |
945 |
930 |
0.984 |
159 |
458 |
|
|
3 |
A1 |
424 |
430 |
1.014 |
159 |
459 |
|
|
4 |
E |
2274 |
2196 |
0.966 |
159 |
460 |
|
|
5 |
E |
958 |
950 |
0.992 |
159 |
461 |
|
|
6 |
E |
634 |
633 |
0.998 |
159 |
462 |
CH2BrCl |
Methane, bromochloro- |
1 |
A' |
3151 |
3003 |
0.953 |
160 |
463 |
|
|
2 |
A' |
1442 |
1482 |
1.028 |
160 |
464 |
|
|
3 |
A' |
1249 |
1231 |
0.985 |
160 |
465 |
|
|
4 |
A' |
744 |
744 |
1.000 |
160 |
466 |
|
|
5 |
A' |
609 |
614 |
1.007 |
160 |
467 |
|
|
6 |
A' |
227 |
229 |
1.007 |
160 |
468 |
|
|
7 |
A" |
3242 |
3066 |
0.946 |
160 |
469 |
|
|
8 |
A" |
1145 |
1128 |
0.985 |
160 |
470 |
|
|
9 |
A" |
853 |
852 |
0.999 |
160 |
471 |
BrONO2 |
Bromine nitrate |
1 |
A' |
1813 |
1714 |
0.945 |
161 |
472 |
|
|
2 |
A' |
1324 |
1288 |
0.972 |
161 |
473 |
|
|
3 |
A' |
802 |
806 |
1.005 |
161 |
474 |
|
|
4 |
A' |
739 |
750 |
1.015 |
161 |
475 |
|
|
5 |
A' |
530 |
564 |
1.064 |
161 |
476 |
|
|
8 |
A" |
721 |
728 |
1.010 |
161 |
477 |
CHFClBr |
fluorochlorobromomethane |
1 |
A |
3182 |
3026 |
0.951 |
162 |
478 |
|
|
2 |
A |
1327 |
1311 |
0.988 |
162 |
479 |
|
|
3 |
A |
1219 |
1205 |
0.989 |
162 |
480 |
|
|
4 |
A |
1116 |
1078 |
0.966 |
162 |
481 |
|
|
5 |
A |
773 |
788 |
1.019 |
162 |
482 |
|
|
6 |
A |
656 |
664 |
1.013 |
162 |
483 |
|
|
7 |
A |
424 |
427 |
1.007 |
162 |
484 |
|
|
8 |
A |
312 |
315 |
1.008 |
162 |
485 |
|
|
9 |
A |
224 |
226 |
1.008 |
162 |
486 |
CBrCl2F |
bromodichlorofluoromethane |
1 |
A' |
1116 |
1080 |
0.968 |
163 |
487 |
|
|
2 |
A' |
784 |
796 |
1.015 |
163 |
488 |
|
|
3 |
A' |
499 |
502 |
1.005 |
163 |
489 |
|
|
4 |
A' |
336 |
339 |
1.009 |
163 |
490 |
|
|
5 |
A' |
302 |
306 |
1.013 |
163 |
491 |
|
|
6 |
A' |
218 |
218 |
1.000 |
163 |
492 |
|
|
7 |
A" |
826 |
838 |
1.015 |
163 |
493 |
|
|
8 |
A" |
392 |
392 |
0.999 |
163 |
494 |
|
|
9 |
A" |
204 |
204 |
0.999 |
163 |
495 |
CBr2Cl2 |
dibromodichloromethane |
1 |
A1 |
731 |
733 |
1.002 |
164 |
496 |
|
|
2 |
A1 |
381 |
380 |
0.999 |
164 |
497 |
|
|
3 |
A1 |
243 |
242 |
0.995 |
164 |
498 |
|
|
4 |
A1 |
156 |
154 |
0.990 |
164 |
499 |
|
|
5 |
A2 |
177 |
175 |
0.990 |
164 |
500 |
|
|
6 |
B1 |
682 |
683 |
1.001 |
164 |
501 |
|
|
7 |
B1 |
232 |
229 |
0.988 |
164 |
502 |
|
|
8 |
B2 |
764 |
768 |
1.005 |
164 |
503 |
|
|
9 |
B2 |
266 |
262 |
0.986 |
164 |
504 |
CFBr3 |
fluorotribromomethane |
1 |
A1 |
1106 |
1069 |
0.966 |
165 |
505 |
|
|
2 |
A1 |
397 |
398 |
1.003 |
165 |
506 |
|
|
3 |
A1 |
218 |
218 |
0.999 |
165 |
507 |
|
|
4 |
E |
730 |
743 |
1.017 |
165 |
508 |
|
|
5 |
E |
305 |
306 |
1.003 |
165 |
509 |
|
|
6 |
E |
150 |
150 |
1.000 |
165 |
510 |
CBr3Cl |
tribromochloromethane |
1 |
A1 |
742 |
747 |
1.006 |
166 |
511 |
|
|
2 |
A1 |
330 |
329 |
0.997 |
166 |
512 |
|
|
3 |
A1 |
212 |
210 |
0.990 |
166 |
513 |
|
|
4 |
E |
672 |
675 |
1.005 |
166 |
514 |
|
|
5 |
E |
218 |
211 |
0.969 |
166 |
515 |
|
|
6 |
E |
143 |
141 |
0.986 |
166 |
516 |
SiBr4 |
Silicon tetrabromide |
1 |
A1 |
244 |
249 |
1.021 |
167 |
517 |
|
|
2 |
E |
85 |
90 |
1.058 |
167 |
518 |
|
|
3 |
T2 |
492 |
487 |
0.991 |
167 |
519 |
|
|
4 |
T2 |
133 |
137 |
1.028 |
167 |
520 |
C2H4 |
Ethylene |
1 |
Ag |
3179 |
3026 |
0.952 |
168 |
521 |
|
|
2 |
Ag |
1695 |
1623 |
0.958 |
168 |
522 |
|
|
3 |
Ag |
1374 |
1342 |
0.977 |
168 |
523 |
|
|
4 |
Au |
1064 |
1023 |
0.962 |
168 |
524 |
|
|
5 |
B1u |
3161 |
2989 |
0.945 |
168 |
525 |
|
|
6 |
B1u |
1461 |
1444 |
0.988 |
168 |
526 |
|
|
7 |
B2g |
953 |
940 |
0.986 |
168 |
527 |
|
|
8 |
B2u |
3276 |
3105 |
0.948 |
168 |
528 |
|
|
9 |
B2u |
829 |
826 |
0.996 |
168 |
529 |
|
|
10 |
B3g |
3250 |
3086 |
0.950 |
168 |
530 |
|
|
11 |
B3g |
1238 |
1217 |
0.983 |
168 |
531 |
|
|
12 |
B3u |
974 |
949 |
0.975 |
168 |
532 |
C4H2 |
Diacetylene |
6 |
Πg |
640 |
627 |
0.979 |
169 |
533 |
|
|
7 |
Πg |
552 |
482 |
0.873 |
169 |
534 |
|
|
8 |
Πu |
631 |
630 |
0.998 |
169 |
535 |
|
|
9 |
Πu |
239 |
231 |
0.967 |
169 |
536 |
N2H4 |
Hydrazine |
1 |
A |
3548 |
3398 |
0.958 |
170 |
537 |
|
|
2 |
A |
3445 |
3329 |
0.966 |
170 |
538 |
|
|
3 |
A |
1690 |
1642 |
0.972 |
170 |
539 |
|
|
4 |
A |
1357 |
1275 |
0.940 |
170 |
540 |
|
|
5 |
A |
1136 |
1076 |
0.947 |
170 |
541 |
|
|
6 |
A |
857 |
780 |
0.910 |
170 |
542 |
|
|
7 |
A |
412 |
377 |
0.914 |
170 |
543 |
|
|
8 |
B |
3555 |
3350 |
0.942 |
170 |
544 |
|
|
9 |
B |
3430 |
3314 |
0.966 |
170 |
545 |
|
|
10 |
B |
1676 |
1628 |
0.971 |
170 |
546 |
|
|
11 |
B |
1317 |
1275 |
0.968 |
170 |
547 |
|
|
12 |
B |
1053 |
966 |
0.918 |
170 |
548 |
CHNCH2 |
2H-Azirine |
1 |
A' |
3236 |
3078 |
0.951 |
171 |
549 |
|
|
2 |
A' |
3125 |
3006 |
0.962 |
171 |
550 |
|
|
3 |
A' |
1702 |
1669 |
0.980 |
171 |
551 |
|
|
5 |
A' |
1309 |
1241 |
0.948 |
171 |
552 |
|
|
7 |
A' |
988 |
979 |
0.991 |
171 |
553 |
|
|
9 |
A" |
3225 |
3062 |
0.949 |
171 |
554 |
|
|
12 |
A" |
789 |
767 |
0.972 |
171 |
555 |
HCCNH2 |
Ethynamine |
1 |
A' |
3525 |
3400 |
0.964 |
172 |
556 |
|
|
2 |
A' |
3515 |
3330 |
0.947 |
172 |
557 |
|
|
3 |
A' |
2230 |
2155 |
0.967 |
172 |
558 |
CH3OH |
Methyl alcohol |
1 |
A' |
3828 |
3681 |
0.962 |
173 |
559 |
|
|
2 |
A' |
3148 |
3000 |
0.953 |
173 |
560 |
|
|
3 |
A' |
3008 |
2844 |
0.945 |
173 |
561 |
|
|
4 |
A' |
1506 |
1477 |
0.981 |
173 |
562 |
|
|
5 |
A' |
1485 |
1455 |
0.980 |
173 |
563 |
|
|
6 |
A' |
1393 |
1345 |
0.965 |
173 |
564 |
|
|
7 |
A' |
1101 |
1060 |
0.963 |
173 |
565 |
|
|
8 |
A' |
1073 |
1033 |
0.963 |
173 |
566 |
|
|
9 |
A" |
3061 |
2960 |
0.967 |
173 |
567 |
|
|
10 |
A" |
1488 |
1477 |
0.992 |
173 |
568 |
|
|
11 |
A" |
1170 |
1165 |
0.995 |
173 |
569 |
|
|
12 |
A" |
340 |
200 |
0.589 |
173 |
570 |
H2OH2O |
water dimer |
1 |
A' |
3878 |
3735 |
0.963 |
174 |
571 |
|
|
2 |
A' |
3793 |
3660 |
0.965 |
174 |
572 |
|
|
3 |
A' |
3719 |
3601 |
0.968 |
174 |
573 |
|
|
4 |
A' |
1705 |
1616 |
0.948 |
174 |
574 |
|
|
5 |
A' |
1667 |
1599 |
0.959 |
174 |
575 |
|
|
6 |
A' |
408 |
311 |
0.763 |
174 |
576 |
|
|
7 |
A' |
209 |
143 |
0.685 |
174 |
577 |
|
|
8 |
A' |
149 |
103 |
0.691 |
174 |
578 |
|
|
9 |
A" |
3898 |
3745 |
0.961 |
174 |
579 |
|
|
10 |
A" |
676 |
523 |
0.773 |
174 |
580 |
|
|
11 |
A" |
179 |
108 |
0.603 |
174 |
581 |
|
|
12 |
A" |
45 |
88 |
1.969 |
174 |
582 |
BH3CO |
Borane carbonyl |
1 |
A1 |
2487 |
2380 |
0.957 |
175 |
583 |
|
|
2 |
A1 |
2179 |
2165 |
0.993 |
175 |
584 |
|
|
3 |
A1 |
1091 |
1073 |
0.984 |
175 |
585 |
|
|
4 |
A1 |
726 |
691 |
0.952 |
175 |
586 |
|
|
5 |
E |
2568 |
2444 |
0.952 |
175 |
587 |
|
|
6 |
E |
1119 |
1106 |
0.988 |
175 |
588 |
|
|
7 |
E |
824 |
809 |
0.982 |
175 |
589 |
|
|
8 |
E |
303 |
313 |
1.034 |
175 |
590 |
CHONH2 |
formamide |
1 |
A' |
3749 |
3564 |
0.951 |
176 |
591 |
|
|
2 |
A' |
3596 |
3439 |
0.957 |
176 |
592 |
|
|
3 |
A' |
2963 |
2854 |
0.963 |
176 |
593 |
|
|
4 |
A' |
1828 |
1754 |
0.960 |
176 |
594 |
|
|
5 |
A' |
1597 |
1577 |
0.987 |
176 |
595 |
|
|
6 |
A' |
1419 |
1390 |
0.979 |
176 |
596 |
|
|
7 |
A' |
1281 |
1258 |
0.982 |
176 |
597 |
|
|
8 |
A' |
1054 |
1046 |
0.992 |
176 |
598 |
|
|
9 |
A' |
565 |
581 |
1.027 |
176 |
599 |
|
|
10 |
A" |
1050 |
1021 |
0.972 |
176 |
600 |
|
|
11 |
A" |
652 |
603 |
0.925 |
176 |
601 |
|
|
12 |
A" |
144i |
289 |
-2.009 |
176 |
602 |
CH2NOH |
formaldoxime |
1 |
A' |
3812 |
3650 |
0.958 |
177 |
603 |
|
|
2 |
A' |
3275 |
3110 |
0.949 |
177 |
604 |
|
|
3 |
A' |
3135 |
2973 |
0.948 |
177 |
605 |
|
|
4 |
A' |
1702 |
1639 |
0.963 |
177 |
606 |
|
|
5 |
A' |
1444 |
1410 |
0.977 |
177 |
607 |
|
|
6 |
A' |
1354 |
1319 |
0.974 |
177 |
608 |
|
|
7 |
A' |
1178 |
1166 |
0.990 |
177 |
609 |
|
|
8 |
A' |
937 |
893 |
0.952 |
177 |
610 |
|
|
9 |
A' |
531 |
530 |
0.997 |
177 |
611 |
|
|
10 |
A" |
960 |
953 |
0.992 |
177 |
612 |
|
|
11 |
A" |
803 |
774 |
0.964 |
177 |
613 |
|
|
12 |
A" |
432 |
400 |
0.925 |
177 |
614 |
CH3NO |
nitrosomethane |
1 |
A' |
3177 |
2991 |
0.941 |
178 |
615 |
|
|
2 |
A' |
3051 |
2901 |
0.951 |
178 |
616 |
|
|
4 |
A' |
1442 |
1564 |
1.084 |
178 |
617 |
|
|
5 |
A' |
1360 |
1348 |
0.991 |
178 |
618 |
|
|
6 |
A' |
1149 |
967 |
0.842 |
178 |
619 |
|
|
7 |
A' |
860 |
842 |
0.979 |
178 |
620 |
|
|
8 |
A' |
577 |
574 |
0.995 |
178 |
621 |
|
|
9 |
A" |
3154 |
2955 |
0.937 |
178 |
622 |
|
|
10 |
A" |
1446 |
1410 |
0.975 |
178 |
623 |
|
|
11 |
A" |
966 |
916 |
0.949 |
178 |
624 |
CH3SH |
Methanethiol |
1 |
A' |
3183 |
3000 |
0.942 |
179 |
625 |
|
|
2 |
A' |
3080 |
2931 |
0.952 |
179 |
626 |
|
|
3 |
A' |
2713 |
2597 |
0.957 |
179 |
627 |
|
|
4 |
A' |
1479 |
1475 |
0.997 |
179 |
628 |
|
|
5 |
A' |
1351 |
1335 |
0.988 |
179 |
629 |
|
|
6 |
A' |
1097 |
1074 |
0.979 |
179 |
630 |
|
|
7 |
A' |
800 |
803 |
1.004 |
179 |
631 |
|
|
8 |
A' |
715 |
708 |
0.990 |
179 |
632 |
|
|
9 |
A" |
3180 |
3000 |
0.943 |
179 |
633 |
|
|
10 |
A" |
1467 |
1430 |
0.975 |
179 |
634 |
|
|
11 |
A" |
971 |
976 |
1.005 |
179 |
635 |
CHSNH2 |
thioformamide |
1 |
A' |
3720 |
3481 |
0.936 |
180 |
636 |
|
|
2 |
A' |
3569 |
3320 |
0.930 |
180 |
637 |
|
|
3 |
A' |
3118 |
2990 |
0.959 |
180 |
638 |
|
|
4 |
A' |
1625 |
1612 |
0.992 |
180 |
639 |
|
|
5 |
A' |
1469 |
1443 |
0.982 |
180 |
640 |
|
|
6 |
A' |
1326 |
1325 |
1.000 |
180 |
641 |
|
|
7 |
A' |
1139 |
1125 |
0.988 |
180 |
642 |
|
|
8 |
A' |
891 |
843 |
0.946 |
180 |
643 |
|
|
9 |
A' |
433 |
439 |
1.013 |
180 |
644 |
|
|
10 |
A" |
964 |
985 |
1.022 |
180 |
645 |
|
|
11 |
A" |
635 |
670 |
1.055 |
180 |
646 |
|
|
12 |
A" |
269 |
393 |
1.464 |
180 |
647 |
CHFCHClz |
(Z)-1-Chloro-2-fluoroethene |
1 |
A' |
3274 |
3114 |
0.951 |
181 |
648 |
|
|
2 |
A' |
3242 |
3102 |
0.957 |
181 |
649 |
|
|
3 |
A' |
1734 |
1661 |
0.958 |
181 |
650 |
|
|
4 |
A' |
1357 |
1335 |
0.984 |
181 |
651 |
|
|
5 |
A' |
1258 |
1231 |
0.979 |
181 |
652 |
|
|
6 |
A' |
1083 |
1062 |
0.981 |
181 |
653 |
|
|
7 |
A' |
815 |
812 |
0.996 |
181 |
654 |
|
|
8 |
A' |
662 |
656 |
0.992 |
181 |
655 |
|
|
9 |
A' |
194 |
205 |
1.057 |
181 |
656 |
|
|
10 |
A" |
889 |
857 |
0.964 |
181 |
657 |
|
|
11 |
A" |
758 |
735 |
0.969 |
181 |
658 |
|
|
12 |
A" |
457 |
442 |
0.967 |
181 |
659 |
CHFCHCl |
(E)-1-chloro-2-fluoroethene |
1 |
A' |
3262 |
3103 |
0.951 |
182 |
660 |
|
|
2 |
A' |
3253 |
3094 |
0.951 |
182 |
661 |
|
|
3 |
A' |
1720 |
1647 |
0.958 |
182 |
662 |
|
|
4 |
A' |
1317 |
1296 |
0.984 |
182 |
663 |
|
|
5 |
A' |
1224 |
1218 |
0.995 |
182 |
664 |
|
|
6 |
A' |
1160 |
1127 |
0.972 |
182 |
665 |
|
|
7 |
A' |
883 |
876 |
0.992 |
182 |
666 |
|
|
8 |
A' |
451 |
447 |
0.992 |
182 |
667 |
|
|
9 |
A' |
270 |
270 |
1.001 |
182 |
668 |
|
|
10 |
A" |
933 |
888 |
0.952 |
182 |
669 |
|
|
11 |
A" |
804 |
784 |
0.976 |
182 |
670 |
|
|
12 |
A" |
275 |
270 |
0.981 |
182 |
671 |
C2H2ClF |
1-chloro-1-fluoroethylene |
1 |
A' |
3334 |
3159 |
0.948 |
183 |
672 |
|
|
2 |
A' |
3216 |
3072 |
0.955 |
183 |
673 |
|
|
3 |
A' |
1731 |
1656 |
0.957 |
183 |
674 |
|
|
4 |
A' |
1397 |
1375 |
0.984 |
183 |
675 |
|
|
5 |
A' |
1212 |
1188 |
0.981 |
183 |
676 |
|
|
6 |
A' |
962 |
948 |
0.985 |
183 |
677 |
|
|
7 |
A' |
696 |
700 |
1.006 |
183 |
678 |
|
|
8 |
A' |
432 |
432 |
1.002 |
183 |
679 |
|
|
9 |
A' |
373 |
370 |
0.992 |
183 |
680 |
|
|
10 |
A" |
845 |
836 |
0.988 |
183 |
681 |
|
|
11 |
A" |
725 |
700 |
0.965 |
183 |
682 |
|
|
12 |
A" |
538 |
515 |
0.957 |
183 |
683 |
CF2CCl2 |
difluorodichloroethylene |
1 |
A1 |
1805 |
1749 |
0.969 |
184 |
684 |
|
|
2 |
A1 |
1046 |
1032 |
0.987 |
184 |
685 |
|
|
3 |
A1 |
631 |
622 |
0.986 |
184 |
686 |
|
|
4 |
A1 |
436 |
434 |
0.996 |
184 |
687 |
|
|
5 |
A1 |
258 |
258 |
1.002 |
184 |
688 |
|
|
6 |
A2 |
156 |
167 |
1.071 |
184 |
689 |
|
|
7 |
B1 |
601 |
564 |
0.938 |
184 |
690 |
|
|
8 |
B1 |
323 |
323 |
1.000 |
184 |
691 |
|
|
9 |
B2 |
1360 |
1327 |
0.976 |
184 |
692 |
|
|
10 |
B2 |
987 |
989 |
1.002 |
184 |
693 |
|
|
11 |
B2 |
460 |
459 |
0.998 |
184 |
694 |
|
|
12 |
B2 |
183 |
192 |
1.049 |
184 |
695 |
CFClCFCl |
cis-1,2-dichloro-1,2-difluoroethylene |
1 |
A1 |
1775 |
1709 |
0.963 |
185 |
696 |
|
|
2 |
A1 |
1183 |
1168 |
0.987 |
185 |
697 |
|
|
3 |
A1 |
569 |
565 |
0.994 |
185 |
698 |
|
|
4 |
A1 |
328 |
327 |
0.997 |
185 |
699 |
|
|
5 |
A1 |
169 |
169 |
0.998 |
185 |
700 |
|
|
6 |
A2 |
549 |
|
|
185 |
701 |
|
|
7 |
A2 |
148 |
150 |
1.015 |
185 |
702 |
|
|
8 |
B1 |
353 |
|
|
185 |
703 |
|
|
9 |
B2 |
1229 |
1209 |
0.984 |
185 |
704 |
|
|
10 |
B2 |
961 |
958 |
0.996 |
185 |
705 |
|
|
11 |
B2 |
432 |
431 |
0.997 |
185 |
706 |
|
|
12 |
B2 |
416 |
415 |
0.998 |
185 |
707 |
CFClCClF |
trans-1,2-dichloro-1,2-difluoroethylene |
1 |
Ag |
1787 |
1707 |
0.955 |
186 |
708 |
|
|
2 |
Ag |
1215 |
1186 |
0.976 |
186 |
709 |
|
|
3 |
Ag |
642 |
632 |
0.985 |
186 |
710 |
|
|
4 |
Ag |
428 |
425 |
0.994 |
186 |
711 |
|
|
5 |
Ag |
291 |
288 |
0.991 |
186 |
712 |
|
|
6 |
Au |
374 |
333 |
0.890 |
186 |
713 |
|
|
7 |
Au |
136 |
140 |
1.028 |
186 |
714 |
|
|
8 |
Bg |
553 |
529 |
0.957 |
186 |
715 |
|
|
9 |
Bu |
1245 |
1190 |
0.956 |
186 |
716 |
|
|
10 |
Bu |
884 |
892 |
1.009 |
186 |
717 |
|
|
11 |
Bu |
425 |
426 |
1.002 |
186 |
718 |
|
|
12 |
Bu |
176 |
175 |
0.997 |
186 |
719 |
B2Cl4 |
Diboron tetrachloride |
1 |
A1 |
1163 |
1122 |
0.965 |
187 |
720 |
|
|
2 |
A1 |
407 |
401 |
0.984 |
187 |
721 |
|
|
3 |
A1 |
174 |
176 |
1.014 |
187 |
722 |
|
|
5 |
B2 |
740 |
728 |
0.984 |
187 |
723 |
|
|
6 |
B2 |
292 |
289 |
0.990 |
187 |
724 |
|
|
7 |
E |
937 |
917 |
0.979 |
187 |
725 |
|
|
8 |
E |
497 |
512 |
1.031 |
187 |
726 |
|
|
9 |
E |
97 |
104 |
1.073 |
187 |
727 |
CHBrCHBr |
Ethene, 1,2-dibromo-, (Z)- |
1 |
A1 |
3250 |
3060 |
0.941 |
188 |
728 |
|
|
2 |
A1 |
1639 |
1584 |
0.967 |
188 |
729 |
|
|
8 |
B1 |
687 |
3079 |
4.483 |
188 |
730 |
CHBrCHBr |
Ethene, 1,2-dibromo-, (E)- |
1 |
Ag |
3259 |
3089 |
0.948 |
189 |
731 |
|
|
2 |
Ag |
1634 |
1581 |
0.968 |
189 |
732 |
|
|
9 |
Bu |
3255 |
3098 |
0.952 |
189 |
733 |
C2H5 |
Ethyl radical |
1 |
A' |
3176 |
3033 |
0.955 |
190 |
734 |
|
|
2 |
A' |
3087 |
2842 |
0.921 |
190 |
735 |
|
|
5 |
A' |
1460 |
1440 |
0.986 |
190 |
736 |
|
|
6 |
A' |
1393 |
1366 |
0.981 |
190 |
737 |
|
|
7 |
A' |
1085 |
1138 |
1.049 |
190 |
738 |
|
|
9 |
A' |
459 |
528 |
1.151 |
190 |
739 |
|
|
10 |
A" |
3286 |
3112 |
0.947 |
190 |
740 |
|
|
11 |
A" |
3136 |
2987 |
0.952 |
190 |
741 |
|
|
12 |
A" |
1472 |
1440 |
0.978 |
190 |
742 |
|
|
13 |
A" |
1194 |
1175 |
0.984 |
190 |
743 |
CH2CCH2 |
allene |
1 |
A1 |
3161 |
3015 |
0.954 |
191 |
744 |
|
|
2 |
A1 |
1475 |
1443 |
0.978 |
191 |
745 |
|
|
3 |
A1 |
1107 |
1073 |
0.969 |
191 |
746 |
|
|
4 |
B1 |
879 |
865 |
0.984 |
191 |
747 |
|
|
5 |
B2 |
3159 |
3007 |
0.952 |
191 |
748 |
|
|
6 |
B2 |
2061 |
1957 |
0.950 |
191 |
749 |
|
|
7 |
B2 |
1418 |
1398 |
0.986 |
191 |
750 |
|
|
8 |
E |
3251 |
3086 |
0.949 |
191 |
751 |
|
|
9 |
E |
1014 |
999 |
0.986 |
191 |
752 |
|
|
10 |
E |
854 |
841 |
0.985 |
191 |
753 |
|
|
11 |
E |
369 |
355 |
0.963 |
191 |
754 |
CH3NH2 |
methyl amine |
1 |
A' |
3490 |
3361 |
0.963 |
192 |
755 |
|
|
2 |
A' |
3094 |
2961 |
0.957 |
192 |
756 |
|
|
3 |
A' |
2990 |
2820 |
0.943 |
192 |
757 |
|
|
4 |
A' |
1665 |
1623 |
0.975 |
192 |
758 |
|
|
5 |
A' |
1491 |
1473 |
0.988 |
192 |
759 |
|
|
6 |
A' |
1457 |
1430 |
0.981 |
192 |
760 |
|
|
7 |
A' |
1188 |
1130 |
0.952 |
192 |
761 |
|
|
8 |
A' |
1081 |
1044 |
0.966 |
192 |
762 |
|
|
9 |
A' |
891 |
780 |
0.876 |
192 |
763 |
|
|
10 |
A" |
3568 |
3427 |
0.960 |
192 |
764 |
|
|
11 |
A" |
3136 |
2985 |
0.952 |
192 |
765 |
|
|
12 |
A" |
1512 |
1485 |
0.982 |
192 |
766 |
|
|
13 |
A" |
1363 |
1335 |
0.979 |
192 |
767 |
|
|
14 |
A" |
986 |
|
|
192 |
768 |
|
|
15 |
A" |
335 |
268 |
0.800 |
192 |
769 |
CH2N4 |
1H-Tetrazole |
1 |
A' |
3656 |
3447 |
0.943 |
193 |
770 |
|
|
2 |
A' |
3317 |
3102 |
0.935 |
193 |
771 |
|
|
3 |
A' |
1499 |
1441 |
0.962 |
193 |
772 |
|
|
4 |
A' |
1463 |
1384 |
0.946 |
193 |
773 |
|
|
5 |
A' |
1272 |
1259 |
0.989 |
193 |
774 |
|
|
6 |
A' |
1257 |
1159 |
0.922 |
193 |
775 |
|
|
7 |
A' |
1142 |
1084 |
0.949 |
193 |
776 |
|
|
8 |
A' |
1065 |
1015 |
0.953 |
193 |
777 |
|
|
9 |
A' |
1054 |
1002 |
0.950 |
193 |
778 |
|
|
10 |
A' |
1008 |
969 |
0.961 |
193 |
779 |
|
|
11 |
A' |
965 |
925 |
0.959 |
193 |
780 |
|
|
12 |
A" |
853 |
906 |
1.062 |
193 |
781 |
|
|
13 |
A" |
739 |
663 |
0.897 |
193 |
782 |
|
|
14 |
A" |
692 |
658 |
0.950 |
193 |
783 |
|
|
15 |
A" |
576 |
578 |
1.003 |
193 |
784 |
CH3CHO |
Acetaldehyde |
1 |
A' |
3186 |
3014 |
0.946 |
194 |
785 |
|
|
2 |
A' |
3058 |
2923 |
0.956 |
194 |
786 |
|
|
3 |
A' |
2902 |
2716 |
0.936 |
194 |
787 |
|
|
4 |
A' |
1814 |
1743 |
0.961 |
194 |
788 |
|
|
5 |
A' |
1449 |
1433 |
0.989 |
194 |
789 |
|
|
6 |
A' |
1423 |
1395 |
0.981 |
194 |
790 |
|
|
7 |
A' |
1371 |
1352 |
0.986 |
194 |
791 |
|
|
8 |
A' |
1132 |
1114 |
0.985 |
194 |
792 |
|
|
9 |
A' |
899 |
867 |
0.964 |
194 |
793 |
|
|
10 |
A' |
504 |
509 |
1.010 |
194 |
794 |
|
|
11 |
A" |
3133 |
2964 |
0.946 |
194 |
795 |
|
|
12 |
A" |
1463 |
1431 |
0.978 |
194 |
796 |
|
|
13 |
A" |
1131 |
1102 |
0.974 |
194 |
797 |
|
|
14 |
A" |
778 |
764 |
0.983 |
194 |
798 |
|
|
15 |
A" |
171 |
150 |
0.878 |
194 |
799 |
C2H4S |
Thiirane |
1 |
A1 |
3151 |
3014 |
0.956 |
195 |
800 |
|
|
2 |
A1 |
1490 |
1457 |
0.978 |
195 |
801 |
|
|
5 |
A1 |
644 |
627 |
0.974 |
195 |
802 |
|
|
11 |
B1 |
835 |
824 |
0.988 |
195 |
803 |
|
|
12 |
B2 |
3148 |
3013 |
0.957 |
195 |
804 |
|
|
14 |
B2 |
1063 |
1051 |
0.989 |
195 |
805 |
F2CCCF2 |
tetrafluoroallene |
1 |
A1 |
1597 |
1560 |
0.977 |
196 |
806 |
|
|
2 |
A1 |
738 |
734 |
0.995 |
196 |
807 |
|
|
3 |
A1 |
393 |
398 |
1.013 |
196 |
808 |
|
|
4 |
B1 |
153 |
165 |
1.079 |
196 |
809 |
|
|
5 |
B2 |
2154 |
2052 |
0.953 |
196 |
810 |
|
|
6 |
B2 |
1050 |
1030 |
0.981 |
196 |
811 |
|
|
7 |
B2 |
583 |
581 |
0.996 |
196 |
812 |
|
|
8 |
E |
1277 |
1248 |
0.977 |
196 |
813 |
|
|
9 |
E |
647 |
613 |
0.948 |
196 |
814 |
|
|
10 |
E |
551 |
550 |
0.998 |
196 |
815 |
|
|
11 |
E |
88 |
90 |
1.019 |
196 |
816 |
CH2ClCCCl |
1,3-dichloropropyne |
1 |
A' |
3110 |
2957 |
0.951 |
197 |
817 |
|
|
2 |
A' |
2315 |
2261 |
0.977 |
197 |
818 |
|
|
3 |
A' |
1464 |
1433 |
0.979 |
197 |
819 |
|
|
4 |
A' |
1284 |
1264 |
0.984 |
197 |
820 |
|
|
5 |
A' |
1134 |
1098 |
0.968 |
197 |
821 |
|
|
6 |
A' |
719 |
709 |
0.986 |
197 |
822 |
|
|
7 |
A' |
632 |
617 |
0.977 |
197 |
823 |
|
|
8 |
A' |
429 |
424 |
0.988 |
197 |
824 |
|
|
9 |
A' |
287 |
282 |
0.983 |
197 |
825 |
|
|
10 |
A' |
95 |
89 |
0.939 |
197 |
826 |
|
|
11 |
A" |
3170 |
2994 |
0.945 |
197 |
827 |
|
|
12 |
A" |
1191 |
1172 |
0.984 |
197 |
828 |
|
|
13 |
A" |
912 |
904 |
0.991 |
197 |
829 |
|
|
14 |
A" |
355 |
337 |
0.950 |
197 |
830 |
|
|
15 |
A" |
185 |
176 |
0.953 |
197 |
831 |
SF5Cl |
sulfur chloropentafluoride |
1 |
A1 |
869 |
851 |
0.980 |
198 |
832 |
|
|
2 |
A1 |
682 |
705 |
1.034 |
198 |
833 |
|
|
3 |
A1 |
574 |
603 |
1.049 |
198 |
834 |
|
|
4 |
A1 |
387 |
404 |
1.043 |
198 |
835 |
|
|
5 |
B1 |
457 |
504 |
1.102 |
198 |
836 |
|
|
6 |
B2 |
639 |
622 |
0.973 |
198 |
837 |
|
|
7 |
B2 |
318 |
|
|
198 |
838 |
|
|
8 |
E |
941 |
909 |
0.966 |
198 |
839 |
|
|
9 |
E |
533 |
592 |
1.111 |
198 |
840 |
|
|
10 |
E |
407 |
441 |
1.082 |
198 |
841 |
|
|
11 |
E |
251 |
273 |
1.087 |
198 |
842 |
SeF6 |
Selenium hexafluoride |
1 |
A1g |
695 |
707 |
1.017 |
199 |
843 |
|
|
2 |
Eg |
668 |
659 |
0.987 |
199 |
844 |
|
|
3 |
T1u |
796 |
780 |
0.980 |
199 |
845 |
|
|
4 |
T1u |
421 |
437 |
1.037 |
199 |
846 |
|
|
5 |
T2g |
378 |
405 |
1.072 |
199 |
847 |
|
|
6 |
T2u |
256 |
264 |
1.029 |
199 |
848 |
B2H6 |
Diborane |
1 |
Ag |
2641 |
2530 |
0.958 |
200 |
849 |
|
|
2 |
Ag |
2190 |
2088 |
0.954 |
200 |
850 |
|
|
3 |
Ag |
1197 |
1183 |
0.988 |
200 |
851 |
|
|
4 |
Ag |
803 |
790 |
0.984 |
200 |
852 |
|
|
5 |
Au |
837 |
833 |
0.996 |
200 |
853 |
|
|
6 |
B1g |
2725 |
2596 |
0.953 |
200 |
854 |
|
|
7 |
B1g |
928 |
915 |
0.986 |
200 |
855 |
|
|
8 |
B1u |
2012 |
1930 |
0.959 |
200 |
856 |
|
|
9 |
B1u |
989 |
973 |
0.983 |
200 |
857 |
|
|
10 |
B2g |
1863 |
1760 |
0.945 |
200 |
858 |
|
|
11 |
B2g |
875 |
860 |
0.983 |
200 |
859 |
|
|
12 |
B2u |
2738 |
2609 |
0.953 |
200 |
860 |
|
|
13 |
B2u |
948 |
949 |
1.001 |
200 |
861 |
|
|
14 |
B2u |
351 |
369 |
1.049 |
200 |
862 |
|
|
15 |
B3g |
1026 |
1020 |
0.994 |
200 |
863 |
|
|
16 |
B3u |
2625 |
2520 |
0.960 |
200 |
864 |
|
|
17 |
B3u |
1721 |
1603 |
0.931 |
200 |
865 |
|
|
18 |
B3u |
1184 |
1172 |
0.990 |
200 |
866 |
Ga2H6 |
digallane |
1 |
Ag |
2019 |
2000 |
0.990 |
201 |
867 |
|
|
2 |
Ag |
1529 |
1474 |
0.964 |
201 |
868 |
|
|
3 |
Ag |
744 |
736 |
0.989 |
201 |
869 |
|
|
6 |
B1g |
2026 |
2011 |
0.993 |
201 |
870 |
|
|
8 |
B1u |
1258 |
1202 |
0.955 |
201 |
871 |
|
|
9 |
B1u |
655 |
659 |
1.007 |
201 |
872 |
|
|
12 |
B2u |
2032 |
1993 |
0.981 |
201 |
873 |
|
|
13 |
B2u |
794 |
760 |
0.958 |
201 |
874 |
|
|
15 |
B3g |
774 |
763 |
0.986 |
201 |
875 |
|
|
16 |
B3u |
2015 |
1976 |
0.981 |
201 |
876 |
|
|
17 |
B3u |
1357 |
1273 |
0.938 |
201 |
877 |
|
|
18 |
B3u |
686 |
671 |
0.978 |
201 |
878 |
C2H6 |
Ethane |
1 |
A1g |
3063 |
2954 |
0.965 |
202 |
879 |
|
|
2 |
A1g |
1427 |
1388 |
0.973 |
202 |
880 |
|
|
3 |
A1g |
1026 |
995 |
0.970 |
202 |
881 |
|
|
4 |
A1u |
325 |
289 |
0.890 |
202 |
882 |
|
|
5 |
A2u |
3059 |
2896 |
0.947 |
202 |
883 |
|
|
6 |
A2u |
1399 |
1379 |
0.985 |
202 |
884 |
|
|
7 |
Eg |
3126 |
2969 |
0.950 |
202 |
885 |
|
|
8 |
Eg |
1494 |
1468 |
0.983 |
202 |
886 |
|
|
9 |
Eg |
1220 |
1190 |
0.976 |
202 |
887 |
|
|
10 |
Eu |
3149 |
2985 |
0.948 |
202 |
888 |
|
|
11 |
Eu |
1496 |
1469 |
0.982 |
202 |
889 |
|
|
12 |
Eu |
826 |
822 |
0.995 |
202 |
890 |
C3H5 |
Allyl radical |
1 |
A1 |
3285 |
3114 |
0.948 |
203 |
891 |
|
|
2 |
A1 |
3181 |
3048 |
0.958 |
203 |
892 |
|
|
4 |
A1 |
1520 |
1488 |
0.979 |
203 |
893 |
|
|
5 |
A1 |
1279 |
1245 |
0.973 |
203 |
894 |
|
|
6 |
A1 |
1047 |
1066 |
1.018 |
203 |
895 |
|
|
7 |
A1 |
427 |
427 |
0.999 |
203 |
896 |
|
|
9 |
A2 |
561 |
549 |
0.979 |
203 |
897 |
|
|
10 |
B1 |
1024 |
968 |
0.945 |
203 |
898 |
|
|
11 |
B1 |
805 |
802 |
0.996 |
203 |
899 |
|
|
12 |
B1 |
538 |
518 |
0.963 |
203 |
900 |
|
|
13 |
B2 |
3283 |
3105 |
0.946 |
203 |
901 |
|
|
14 |
B2 |
3171 |
3016 |
0.951 |
203 |
902 |
|
|
15 |
B2 |
1510 |
1463 |
0.969 |
203 |
903 |
|
|
16 |
B2 |
1415 |
1389 |
0.982 |
203 |
904 |
|
|
17 |
B2 |
1198 |
1182 |
0.986 |
203 |
905 |
Si2H6 |
disilane |
1 |
A1g |
2230 |
2152 |
0.965 |
204 |
906 |
|
|
2 |
A1g |
929 |
909 |
0.978 |
204 |
907 |
|
|
3 |
A1g |
430 |
434 |
1.009 |
204 |
908 |
|
|
4 |
A1u |
136 |
131 |
0.961 |
204 |
909 |
|
|
5 |
A2u |
2222 |
2154 |
0.970 |
204 |
910 |
|
|
6 |
A2u |
856 |
844 |
0.985 |
204 |
911 |
|
|
7 |
Eg |
2233 |
2155 |
0.965 |
204 |
912 |
|
|
8 |
Eg |
951 |
929 |
0.977 |
204 |
913 |
|
|
9 |
Eg |
638 |
625 |
0.979 |
204 |
914 |
|
|
10 |
Eu |
2242 |
2179 |
0.972 |
204 |
915 |
|
|
11 |
Eu |
965 |
940 |
0.974 |
204 |
916 |
|
|
12 |
Eu |
375 |
379 |
1.012 |
204 |
917 |
BH3NH3 |
borane ammonia |
1 |
A1 |
3474 |
3337 |
0.960 |
205 |
918 |
|
|
2 |
A1 |
2462 |
2299 |
0.934 |
205 |
919 |
|
|
3 |
A1 |
1326 |
1289 |
0.972 |
205 |
920 |
|
|
4 |
A1 |
1192 |
1178 |
0.988 |
205 |
921 |
|
|
5 |
A1 |
662 |
603 |
0.911 |
205 |
922 |
|
|
7 |
E |
3593 |
3418 |
0.951 |
205 |
923 |
|
|
8 |
E |
2526 |
2406 |
0.952 |
205 |
924 |
|
|
9 |
E |
1658 |
1611 |
0.971 |
205 |
925 |
|
|
10 |
E |
1188 |
1186 |
0.998 |
205 |
926 |
|
|
11 |
E |
1067 |
1042 |
0.977 |
205 |
927 |
C4H2N2 |
Fumaronitrile |
1 |
Ag |
3222 |
3050 |
0.946 |
206 |
928 |
|
|
2 |
Ag |
2263 |
2230 |
0.986 |
206 |
929 |
|
|
3 |
Ag |
1673 |
1610 |
0.962 |
206 |
930 |
|
|
4 |
Ag |
1312 |
1295 |
0.987 |
206 |
931 |
|
|
5 |
Ag |
1025 |
1000 |
0.975 |
206 |
932 |
|
|
6 |
Ag |
533 |
534 |
1.003 |
206 |
933 |
|
|
7 |
Ag |
252 |
261 |
1.035 |
206 |
934 |
|
|
8 |
Au |
980 |
940 |
0.960 |
206 |
935 |
|
|
9 |
Au |
549 |
545 |
0.992 |
206 |
936 |
|
|
10 |
Au |
126 |
|
|
206 |
937 |
|
|
11 |
Bg |
852 |
845 |
0.991 |
206 |
938 |
|
|
12 |
Bg |
380 |
383 |
1.007 |
206 |
939 |
|
|
13 |
Bu |
3228 |
3050 |
0.945 |
206 |
940 |
|
|
14 |
Bu |
2278 |
2243 |
0.984 |
206 |
941 |
|
|
15 |
Bu |
1274 |
1259 |
0.988 |
206 |
942 |
|
|
16 |
Bu |
1029 |
1000 |
0.972 |
206 |
943 |
|
|
17 |
Bu |
527 |
534 |
1.012 |
206 |
944 |
|
|
18 |
Bu |
135 |
148 |
1.098 |
206 |
945 |
BH3PH3 |
borane phosphine |
1 |
A1 |
2495 |
2401 |
0.962 |
207 |
946 |
|
|
2 |
A1 |
2479 |
2363 |
0.953 |
207 |
947 |
|
|
3 |
A1 |
1104 |
1069 |
0.968 |
207 |
948 |
|
|
4 |
A1 |
1026 |
978 |
0.954 |
207 |
949 |
|
|
5 |
A1 |
516 |
572 |
1.109 |
207 |
950 |
|
|
7 |
E |
2568 |
2426 |
0.945 |
207 |
951 |
|
|
8 |
E |
2510 |
2408 |
0.960 |
207 |
952 |
|
|
9 |
E |
1157 |
1144 |
0.989 |
207 |
953 |
|
|
10 |
E |
1138 |
1102 |
0.968 |
207 |
954 |
|
|
11 |
E |
842 |
826 |
0.981 |
207 |
955 |
|
|
12 |
E |
378 |
447 |
1.183 |
207 |
956 |
C3H3NO |
Oxazole |
1 |
A' |
3331 |
3170 |
0.952 |
208 |
957 |
|
|
2 |
A' |
3309 |
3144 |
0.950 |
208 |
958 |
|
|
3 |
A' |
3292 |
3141 |
0.954 |
208 |
959 |
|
|
4 |
A' |
1577 |
1537 |
0.975 |
208 |
960 |
|
|
5 |
A' |
1538 |
1504 |
0.978 |
208 |
961 |
|
|
6 |
A' |
1360 |
1324 |
0.974 |
208 |
962 |
|
|
7 |
A' |
1267 |
1252 |
0.988 |
208 |
963 |
|
|
8 |
A' |
1168 |
1139 |
0.975 |
208 |
964 |
|
|
9 |
A' |
1137 |
1086 |
0.955 |
208 |
965 |
|
|
10 |
A' |
1101 |
1078 |
0.979 |
208 |
966 |
|
|
11 |
A' |
1078 |
1046 |
0.970 |
208 |
967 |
|
|
12 |
A' |
924 |
899 |
0.973 |
208 |
968 |
|
|
13 |
A' |
914 |
854 |
0.934 |
208 |
969 |
|
|
14 |
A" |
869 |
907 |
1.043 |
208 |
970 |
|
|
15 |
A" |
836 |
830 |
0.993 |
208 |
971 |
|
|
16 |
A" |
761 |
750 |
0.986 |
208 |
972 |
|
|
17 |
A" |
666 |
647 |
0.971 |
208 |
973 |
|
|
18 |
A" |
629 |
607 |
0.965 |
208 |
974 |
CH2FCH2Cl |
Ethane, 1-chloro-2-fluoro- |
1 |
A' |
3122 |
2984 |
0.956 |
209 |
975 |
|
|
1 |
A |
3182 |
3025 |
0.951 |
209 |
976 |
|
|
2 |
A |
3130 |
2988 |
0.955 |
209 |
977 |
|
|
2 |
A' |
3087 |
2966 |
0.961 |
209 |
978 |
|
|
3 |
A' |
1510 |
1467 |
0.971 |
209 |
979 |
|
|
3 |
A |
3111 |
2978 |
0.957 |
209 |
980 |
|
|
4 |
A |
3060 |
2966 |
0.969 |
209 |
981 |
|
|
4 |
A' |
1490 |
1436 |
0.964 |
209 |
982 |
|
|
5 |
A' |
1419 |
1397 |
0.984 |
209 |
983 |
|
|
5 |
A |
1491 |
1467 |
0.984 |
209 |
984 |
|
|
6 |
A |
1457 |
1436 |
0.986 |
209 |
985 |
|
|
6 |
A' |
1272 |
1306 |
1.027 |
209 |
986 |
|
|
7 |
A' |
1095 |
1090 |
0.996 |
209 |
987 |
|
|
7 |
A |
1429 |
1387 |
0.971 |
209 |
988 |
|
|
8 |
A |
1331 |
1306 |
0.981 |
209 |
989 |
|
|
8 |
A' |
1068 |
1052 |
0.985 |
209 |
990 |
|
|
9 |
A' |
781 |
779 |
0.997 |
209 |
991 |
|
|
9 |
A |
1273 |
1258 |
0.988 |
209 |
992 |
|
|
10 |
A |
1218 |
1200 |
0.985 |
209 |
993 |
|
|
10 |
A' |
383 |
383 |
1.000 |
209 |
994 |
|
|
11 |
A' |
241 |
245 |
1.016 |
209 |
995 |
|
|
11 |
A |
1125 |
1071 |
0.952 |
209 |
996 |
|
|
12 |
A |
1063 |
1038 |
0.977 |
209 |
997 |
|
|
12 |
A" |
3194 |
3025 |
0.947 |
209 |
998 |
|
|
13 |
A" |
3146 |
3010 |
0.957 |
209 |
999 |
|
|
13 |
A |
980 |
964 |
0.983 |
209 |
1000 |
|
|
14 |
A |
860 |
847 |
0.985 |
209 |
1001 |
|
|
14 |
A" |
1299 |
1258 |
0.968 |
209 |
1002 |
|
|
15 |
A" |
1215 |
1200 |
0.988 |
209 |
1003 |
|
|
15 |
A |
687 |
688 |
1.001 |
209 |
1004 |
|
|
16 |
A |
465 |
467 |
1.003 |
209 |
1005 |
|
|
16 |
A" |
1055 |
964 |
0.914 |
209 |
1006 |
|
|
17 |
A" |
801 |
847 |
1.057 |
209 |
1007 |
|
|
17 |
A |
287 |
286 |
0.998 |
209 |
1008 |
|
|
18 |
A |
131 |
128 |
0.978 |
209 |
1009 |
|
|
18 |
A" |
132 |
138 |
1.049 |
209 |
1010 |
C3H4N2 |
1H-Imidazole |
1 |
A' |
3669 |
3517 |
0.959 |
210 |
1011 |
|
|
2 |
A' |
3307 |
3143 |
0.950 |
210 |
1012 |
|
|
3 |
A' |
3279 |
3123 |
0.952 |
210 |
1013 |
|
|
4 |
A' |
3274 |
3110 |
0.950 |
210 |
1014 |
|
|
5 |
A' |
1558 |
1448 |
0.930 |
210 |
1015 |
|
|
6 |
A' |
1514 |
1404 |
0.927 |
210 |
1016 |
|
|
7 |
A' |
1457 |
1328 |
0.911 |
210 |
1017 |
|
|
8 |
A' |
1374 |
1265 |
0.921 |
210 |
1018 |
|
|
9 |
A' |
1275 |
1188 |
0.932 |
210 |
1019 |
|
|
10 |
A' |
1178 |
1098 |
0.932 |
210 |
1020 |
|
|
11 |
A' |
1144 |
1062 |
0.928 |
210 |
1021 |
|
|
12 |
A' |
1095 |
1013 |
0.925 |
210 |
1022 |
|
|
13 |
A' |
1077 |
988 |
0.917 |
210 |
1023 |
|
|
14 |
A' |
939 |
923 |
0.983 |
210 |
1024 |
|
|
15 |
A' |
902 |
898 |
0.995 |
210 |
1025 |
|
|
16 |
A" |
860 |
831 |
0.966 |
210 |
1026 |
|
|
17 |
A" |
809 |
758 |
0.937 |
210 |
1027 |
|
|
18 |
A" |
726 |
674 |
0.929 |
210 |
1028 |
|
|
19 |
A" |
684 |
663 |
0.970 |
210 |
1029 |
|
|
20 |
A" |
648 |
621 |
0.958 |
210 |
1030 |
|
|
21 |
A" |
514 |
539 |
1.049 |
210 |
1031 |
CH3CH2OH |
Ethanol |
1 |
A' |
3825 |
3653 |
0.955 |
211 |
1032 |
|
|
2 |
A' |
3154 |
2984 |
0.946 |
211 |
1033 |
|
|
3 |
A' |
3068 |
2939 |
0.958 |
211 |
1034 |
|
|
4 |
A' |
2998 |
2900 |
0.967 |
211 |
1035 |
|
|
5 |
A' |
1523 |
1490 |
0.978 |
211 |
1036 |
|
|
6 |
A' |
1494 |
1464 |
0.979 |
211 |
1037 |
|
|
7 |
A' |
1468 |
1412 |
0.961 |
211 |
1038 |
|
|
8 |
A' |
1396 |
1371 |
0.982 |
211 |
1039 |
|
|
9 |
A' |
1284 |
1256 |
0.978 |
211 |
1040 |
|
|
10 |
A' |
1124 |
1091 |
0.970 |
211 |
1041 |
|
|
11 |
A' |
1053 |
1028 |
0.976 |
211 |
1042 |
|
|
12 |
A' |
915 |
888 |
0.970 |
211 |
1043 |
|
|
13 |
A' |
416 |
417 |
1.002 |
211 |
1044 |
|
|
14 |
A" |
3158 |
2991 |
0.947 |
211 |
1045 |
|
|
15 |
A" |
3030 |
2910 |
0.960 |
211 |
1046 |
|
|
16 |
A" |
1472 |
1446 |
0.982 |
211 |
1047 |
|
|
17 |
A" |
1300 |
1275 |
0.980 |
211 |
1048 |
|
|
18 |
A" |
1182 |
1161 |
0.983 |
211 |
1049 |
|
|
19 |
A" |
825 |
812 |
0.984 |
211 |
1050 |
|
|
20 |
A" |
298 |
251 |
0.841 |
211 |
1051 |
|
|
21 |
A" |
254 |
200 |
0.787 |
211 |
1052 |
CH3OCH3 |
Dimethyl ether |
1 |
A1 |
3157 |
2996 |
0.949 |
212 |
1053 |
|
|
2 |
A1 |
2999 |
2817 |
0.939 |
212 |
1054 |
|
|
3 |
A1 |
1513 |
1464 |
0.968 |
212 |
1055 |
|
|
4 |
A1 |
1485 |
1452 |
0.978 |
212 |
1056 |
|
|
5 |
A1 |
1270 |
1244 |
0.979 |
212 |
1057 |
|
|
6 |
A1 |
966 |
928 |
0.961 |
212 |
1058 |
|
|
7 |
A1 |
418 |
418 |
1.000 |
212 |
1059 |
|
|
8 |
A2 |
3049 |
2952 |
0.968 |
212 |
1060 |
|
|
9 |
A2 |
1471 |
1464 |
0.996 |
212 |
1061 |
|
|
10 |
A2 |
1161 |
1150 |
0.991 |
212 |
1062 |
|
|
11 |
A2 |
217 |
203 |
0.934 |
212 |
1063 |
|
|
12 |
B1 |
3043 |
2925 |
0.961 |
212 |
1064 |
|
|
13 |
B1 |
1479 |
1464 |
0.990 |
212 |
1065 |
|
|
14 |
B1 |
1194 |
1179 |
0.988 |
212 |
1066 |
|
|
15 |
B1 |
259 |
242 |
0.936 |
212 |
1067 |
|
|
16 |
B2 |
3155 |
2996 |
0.949 |
212 |
1068 |
|
|
17 |
B2 |
2985 |
2817 |
0.944 |
212 |
1069 |
|
|
18 |
B2 |
1489 |
1464 |
0.983 |
212 |
1070 |
|
|
19 |
B2 |
1453 |
1452 |
0.999 |
212 |
1071 |
|
|
20 |
B2 |
1215 |
1227 |
1.010 |
212 |
1072 |
|
|
21 |
B2 |
1131 |
1102 |
0.975 |
212 |
1073 |
CH3COCCH |
3-butyn-2-one |
1 |
A' |
3488 |
|
|
213 |
1074 |
|
|
2 |
A' |
3191 |
|
|
213 |
1075 |
|
|
3 |
A' |
3067 |
|
|
213 |
1076 |
|
|
4 |
A' |
2161 |
|
|
213 |
1077 |
|
|
5 |
A' |
1758 |
|
|
213 |
1078 |
|
|
6 |
A' |
1448 |
|
|
213 |
1079 |
|
|
7 |
A' |
1382 |
|
|
213 |
1080 |
|
|
8 |
A' |
1217 |
|
|
213 |
1081 |
|
|
9 |
A' |
984 |
|
|
213 |
1082 |
|
|
10 |
A' |
750 |
|
|
213 |
1083 |
|
|
11 |
A' |
653 |
|
|
213 |
1084 |
|
|
12 |
A' |
591 |
|
|
213 |
1085 |
|
|
13 |
A' |
435 |
|
|
213 |
1086 |
|
|
14 |
A' |
170 |
|
|
213 |
1087 |
|
|
15 |
A" |
3146 |
|
|
213 |
1088 |
|
|
16 |
A" |
1458 |
|
|
213 |
1089 |
|
|
17 |
A" |
1040 |
|
|
213 |
1090 |
|
|
18 |
A" |
705 |
|
|
213 |
1091 |
|
|
19 |
A" |
596 |
|
|
213 |
1092 |
|
|
20 |
A" |
239 |
|
|
213 |
1093 |
CH3SeCH3 |
dimethylselenide |
1 |
A1 |
3181 |
2992 |
0.940 |
214 |
1094 |
|
|
2 |
A1 |
3069 |
2920 |
0.952 |
214 |
1095 |
|
|
3 |
A1 |
1471 |
1423 |
0.967 |
214 |
1096 |
|
|
4 |
A1 |
1317 |
1284 |
0.975 |
214 |
1097 |
|
|
5 |
A1 |
976 |
954 |
0.977 |
214 |
1098 |
|
|
6 |
A1 |
597 |
589 |
0.987 |
214 |
1099 |
|
|
7 |
A1 |
211 |
233 |
1.105 |
214 |
1100 |
|
|
8 |
A2 |
3177 |
2996 |
0.943 |
214 |
1101 |
|
|
9 |
A2 |
1450 |
1424 |
0.982 |
214 |
1102 |
|
|
10 |
A2 |
896 |
890 |
0.993 |
214 |
1103 |
|
|
12 |
B1 |
3171 |
2992 |
0.944 |
214 |
1104 |
|
|
13 |
B1 |
1459 |
1423 |
0.975 |
214 |
1105 |
|
|
14 |
B1 |
926 |
908 |
0.980 |
214 |
1106 |
|
|
16 |
B2 |
3182 |
2992 |
0.940 |
214 |
1107 |
|
|
17 |
B2 |
3072 |
2920 |
0.950 |
214 |
1108 |
|
|
18 |
B2 |
1464 |
1423 |
0.972 |
214 |
1109 |
|
|
19 |
B2 |
1293 |
1263 |
0.977 |
214 |
1110 |
|
|
20 |
B2 |
858 |
857 |
0.999 |
214 |
1111 |
|
|
21 |
B2 |
613 |
604 |
0.985 |
214 |
1112 |
CHCCH2CH3 |
1-Butyne |
1 |
A' |
3498 |
3332 |
0.952 |
215 |
1113 |
|
|
2 |
A' |
3154 |
2988 |
0.947 |
215 |
1114 |
|
|
3 |
A' |
3069 |
|
|
215 |
1115 |
|
|
4 |
A' |
3063 |
|
|
215 |
1116 |
|
|
5 |
A' |
2192 |
2116 |
0.966 |
215 |
1117 |
|
|
6 |
A' |
1495 |
1470 |
0.983 |
215 |
1118 |
|
|
7 |
A' |
1467 |
1446 |
0.986 |
215 |
1119 |
|
|
8 |
A' |
1408 |
1385 |
0.983 |
215 |
1120 |
|
|
9 |
A' |
1351 |
1322 |
0.978 |
215 |
1121 |
|
|
10 |
A' |
1095 |
1070 |
0.978 |
215 |
1122 |
|
|
11 |
A' |
1042 |
1008 |
0.967 |
215 |
1123 |
|
|
12 |
A' |
858 |
840 |
0.979 |
215 |
1124 |
|
|
13 |
A' |
641 |
634 |
0.989 |
215 |
1125 |
|
|
14 |
A' |
511 |
509 |
0.997 |
215 |
1126 |
|
|
15 |
A' |
198 |
197 |
0.992 |
215 |
1127 |
|
|
16 |
A" |
3162 |
2988 |
0.945 |
215 |
1128 |
|
|
17 |
A" |
3102 |
2939 |
0.947 |
215 |
1129 |
|
|
18 |
A" |
1485 |
1462 |
0.985 |
215 |
1130 |
|
|
19 |
A" |
1290 |
1261 |
0.978 |
215 |
1131 |
|
|
20 |
A" |
1108 |
1090 |
0.984 |
215 |
1132 |
|
|
21 |
A" |
791 |
782 |
0.989 |
215 |
1133 |
|
|
22 |
A" |
634 |
630 |
0.994 |
215 |
1134 |
|
|
23 |
A" |
355 |
344 |
0.968 |
215 |
1135 |
|
|
24 |
A" |
228 |
213 |
0.935 |
215 |
1136 |
C4H6 |
Bicyclo[1.1.0]butane |
1 |
A1 |
3276 |
3131 |
0.956 |
216 |
1137 |
|
|
2 |
A1 |
3199 |
3044 |
0.951 |
216 |
1138 |
|
|
3 |
A1 |
3085 |
2935 |
0.951 |
216 |
1139 |
|
|
4 |
A1 |
1522 |
1501 |
0.986 |
216 |
1140 |
|
|
5 |
A1 |
1300 |
1266 |
0.974 |
216 |
1141 |
|
|
6 |
A1 |
1108 |
1081 |
0.976 |
216 |
1142 |
|
|
7 |
A1 |
866 |
839 |
0.968 |
216 |
1143 |
|
|
8 |
A1 |
667 |
657 |
0.985 |
216 |
1144 |
|
|
9 |
A1 |
415 |
423 |
1.019 |
216 |
1145 |
|
|
10 |
A2 |
1181 |
1172 |
0.992 |
216 |
1146 |
|
|
11 |
A2 |
1083 |
1063 |
0.982 |
216 |
1147 |
|
|
12 |
A2 |
924 |
909 |
0.984 |
216 |
1148 |
|
|
13 |
A2 |
864 |
838 |
0.970 |
216 |
1149 |
|
|
14 |
B1 |
3264 |
3120 |
0.956 |
216 |
1150 |
|
|
15 |
B1 |
1173 |
1110 |
0.946 |
216 |
1151 |
|
|
16 |
B1 |
1138 |
1092 |
0.960 |
216 |
1152 |
|
|
17 |
B1 |
998 |
980 |
0.982 |
216 |
1153 |
|
|
18 |
B1 |
753 |
737 |
0.979 |
216 |
1154 |
|
|
19 |
B2 |
3202 |
3044 |
0.951 |
216 |
1155 |
|
|
20 |
B2 |
3089 |
2969 |
0.961 |
216 |
1156 |
|
|
21 |
B2 |
1481 |
1485 |
1.002 |
216 |
1157 |
|
|
22 |
B2 |
1328 |
1261 |
0.950 |
216 |
1158 |
|
|
23 |
B2 |
1108 |
1081 |
0.975 |
216 |
1159 |
|
|
24 |
B2 |
945 |
935 |
0.990 |
216 |
1160 |
CH3PHCH3 |
dimethylphosphine |
1 |
A' |
3156 |
2975 |
0.943 |
217 |
1161 |
|
|
2 |
A' |
3151 |
2975 |
0.944 |
217 |
1162 |
|
|
3 |
A' |
3057 |
2918 |
0.955 |
217 |
1163 |
|
|
4 |
A' |
2391 |
2288 |
0.957 |
217 |
1164 |
|
|
5 |
A' |
1468 |
1447 |
0.986 |
217 |
1165 |
|
|
6 |
A' |
1467 |
1434 |
0.977 |
217 |
1166 |
|
|
7 |
A' |
1320 |
1297 |
0.982 |
217 |
1167 |
|
|
8 |
A' |
1013 |
1007 |
0.994 |
217 |
1168 |
|
|
9 |
A' |
962 |
986 |
1.025 |
217 |
1169 |
|
|
10 |
A' |
724 |
714 |
0.986 |
217 |
1170 |
|
|
11 |
A' |
661 |
660 |
0.999 |
217 |
1171 |
|
|
12 |
A' |
255 |
261 |
1.024 |
217 |
1172 |
|
|
13 |
A' |
194 |
191 |
0.983 |
217 |
1173 |
|
|
14 |
A" |
3157 |
2985 |
0.946 |
217 |
1174 |
|
|
15 |
A" |
3153 |
2985 |
0.947 |
217 |
1175 |
|
|
16 |
A" |
3059 |
2923 |
0.956 |
217 |
1176 |
|
|
17 |
A" |
1460 |
1443 |
0.989 |
217 |
1177 |
|
|
18 |
A" |
1454 |
1423 |
0.979 |
217 |
1178 |
|
|
19 |
A" |
1303 |
1284 |
0.985 |
217 |
1179 |
|
|
20 |
A" |
1030 |
1012 |
0.983 |
217 |
1180 |
|
|
21 |
A" |
828 |
818 |
0.988 |
217 |
1181 |
|
|
22 |
A" |
727 |
725 |
0.997 |
217 |
1182 |
|
|
23 |
A" |
705 |
703 |
0.997 |
217 |
1183 |
|
|
24 |
A" |
185 |
184 |
0.997 |
217 |
1184 |
C3H6O |
2-Propen-1-ol |
1 |
A |
3822 |
3675 |
0.962 |
218 |
1185 |
|
|
2 |
A |
3264 |
3102 |
0.950 |
218 |
1186 |
|
|
3 |
A |
3186 |
3022 |
0.948 |
218 |
1187 |
|
|
4 |
A |
3165 |
2995 |
0.946 |
218 |
1188 |
|
|
5 |
A |
3030 |
2934 |
0.968 |
218 |
1189 |
|
|
6 |
A |
2988 |
2866 |
0.959 |
218 |
1190 |
|
|
7 |
A |
1724 |
1654 |
0.959 |
218 |
1191 |
|
|
8 |
A |
1503 |
1453 |
0.967 |
218 |
1192 |
|
|
9 |
A |
1474 |
1414 |
0.959 |
218 |
1193 |
|
|
10 |
A |
1422 |
1384 |
0.973 |
218 |
1194 |
|
|
11 |
A |
1305 |
1320 |
1.011 |
218 |
1195 |
|
|
12 |
A |
1279 |
1293 |
1.011 |
218 |
1196 |
|
|
13 |
A |
1240 |
1191 |
0.961 |
218 |
1197 |
|
|
14 |
A |
1163 |
1132 |
0.973 |
218 |
1198 |
|
|
15 |
A |
1087 |
1110 |
1.021 |
218 |
1199 |
|
|
16 |
A |
1029 |
1038 |
1.009 |
218 |
1200 |
|
|
17 |
A |
971 |
995 |
1.025 |
218 |
1201 |
|
|
18 |
A |
946 |
919 |
0.971 |
218 |
1202 |
|
|
19 |
A |
925 |
885 |
0.957 |
218 |
1203 |
|
|
20 |
A |
653 |
606 |
0.928 |
218 |
1204 |
|
|
22 |
A |
328 |
377 |
1.151 |
218 |
1205 |
|
|
23 |
A |
258 |
277 |
1.072 |
218 |
1206 |
|
|
24 |
A |
115 |
188 |
1.632 |
218 |
1207 |
CH3CH2CHO |
Propanal |
1 |
A' |
3162 |
2981 |
0.943 |
219 |
1208 |
|
|
2 |
A' |
3078 |
2904 |
0.943 |
219 |
1209 |
|
|
3 |
A' |
3043 |
2895 |
0.951 |
219 |
1210 |
|
|
4 |
A' |
2904 |
2809 |
0.967 |
219 |
1211 |
|
|
5 |
A' |
1805 |
1743 |
0.966 |
219 |
1212 |
|
|
6 |
A' |
1491 |
1460 |
0.979 |
219 |
1213 |
|
|
7 |
A' |
1446 |
1416 |
0.979 |
219 |
1214 |
|
|
8 |
A' |
1416 |
1390 |
0.981 |
219 |
1215 |
|
|
9 |
A' |
1404 |
1376 |
0.980 |
219 |
1216 |
|
|
10 |
A' |
1370 |
1335 |
0.974 |
219 |
1217 |
|
|
11 |
A' |
1121 |
1093 |
0.975 |
219 |
1218 |
|
|
12 |
A' |
1010 |
993 |
0.983 |
219 |
1219 |
|
|
13 |
A' |
873 |
848 |
0.972 |
219 |
1220 |
|
|
14 |
A' |
672 |
668 |
0.993 |
219 |
1221 |
|
|
15 |
A' |
260 |
271 |
1.041 |
219 |
1222 |
|
|
16 |
A" |
3163 |
2992 |
0.946 |
219 |
1223 |
|
|
17 |
A" |
3075 |
2942 |
0.957 |
219 |
1224 |
|
|
18 |
A" |
1483 |
1451 |
0.978 |
219 |
1225 |
|
|
19 |
A" |
1280 |
1250 |
0.977 |
219 |
1226 |
|
|
20 |
A" |
1145 |
1118 |
0.976 |
219 |
1227 |
|
|
21 |
A" |
904 |
892 |
0.986 |
219 |
1228 |
|
|
22 |
A" |
676 |
660 |
0.976 |
219 |
1229 |
|
|
23 |
A" |
244 |
220 |
0.903 |
219 |
1230 |
|
|
24 |
A" |
139 |
135 |
0.971 |
219 |
1231 |
C3H6O |
Oxetane |
1 |
A1 |
3107 |
2959 |
0.952 |
220 |
1232 |
|
|
2 |
A1 |
3049 |
2930 |
0.961 |
220 |
1233 |
|
|
3 |
A1 |
1539 |
1473 |
0.957 |
220 |
1234 |
|
|
4 |
A1 |
1480 |
1461 |
0.987 |
220 |
1235 |
|
|
5 |
A1 |
1383 |
1342 |
0.970 |
220 |
1236 |
|
|
6 |
A1 |
1061 |
1134 |
1.069 |
220 |
1237 |
|
|
7 |
A1 |
939 |
1018 |
1.085 |
220 |
1238 |
|
|
8 |
A1 |
824 |
908 |
1.102 |
220 |
1239 |
|
|
9 |
A2 |
3091 |
3000 |
0.971 |
220 |
1240 |
|
|
10 |
A2 |
1235 |
1283 |
1.039 |
220 |
1241 |
|
|
11 |
A2 |
1164 |
1185 |
1.018 |
220 |
1242 |
|
|
12 |
A2 |
840 |
986 |
1.174 |
220 |
1243 |
|
|
13 |
B1 |
3169 |
3007 |
0.949 |
220 |
1244 |
|
|
14 |
B1 |
3090 |
2940 |
0.952 |
220 |
1245 |
|
|
15 |
B1 |
1193 |
1225 |
1.027 |
220 |
1246 |
|
|
16 |
B1 |
1146 |
1142 |
0.997 |
220 |
1247 |
|
|
17 |
B1 |
764 |
836 |
1.094 |
220 |
1248 |
|
|
18 |
B1 |
33 |
90 |
2.743 |
220 |
1249 |
|
|
19 |
B2 |
3039 |
2966 |
0.976 |
220 |
1250 |
|
|
20 |
B2 |
1508 |
1508 |
1.000 |
220 |
1251 |
|
|
21 |
B2 |
1310 |
1458 |
1.113 |
220 |
1252 |
|
|
22 |
B2 |
1265 |
1363 |
1.077 |
220 |
1253 |
|
|
23 |
B2 |
1052 |
1228 |
1.167 |
220 |
1254 |
|
|
24 |
B2 |
959 |
936 |
0.976 |
220 |
1255 |
CH3OCH2CN |
Methoxyacetonitrile |
1 |
A |
3180 |
3018 |
0.949 |
221 |
1256 |
|
|
2 |
A |
3141 |
2985 |
0.950 |
221 |
1257 |
|
|
3 |
A |
3093 |
2958 |
0.956 |
221 |
1258 |
|
|
4 |
A |
3025 |
2945 |
0.974 |
221 |
1259 |
|
|
5 |
A |
3020 |
2922 |
0.968 |
221 |
1260 |
|
|
6 |
A |
2285 |
2245 |
0.982 |
221 |
1261 |
|
|
7 |
A |
1499 |
1472 |
0.982 |
221 |
1262 |
|
|
8 |
A |
1480 |
1452 |
0.981 |
221 |
1263 |
|
|
9 |
A |
1475 |
1439 |
0.976 |
221 |
1264 |
|
|
10 |
A |
1460 |
1431 |
0.980 |
221 |
1265 |
|
|
11 |
A |
1387 |
1368 |
0.986 |
221 |
1266 |
|
|
12 |
A |
1311 |
1287 |
0.982 |
221 |
1267 |
|
|
13 |
A |
1220 |
1199 |
0.983 |
221 |
1268 |
|
|
14 |
A |
1178 |
1161 |
0.986 |
221 |
1269 |
|
|
15 |
A |
1165 |
1127 |
0.967 |
221 |
1270 |
|
|
16 |
A |
1030 |
1016 |
0.986 |
221 |
1271 |
|
|
17 |
A |
956 |
925 |
0.967 |
221 |
1272 |
|
|
18 |
A |
905 |
890 |
0.984 |
221 |
1273 |
|
|
19 |
A |
596 |
586 |
0.983 |
221 |
1274 |
|
|
20 |
A |
391 |
404 |
1.032 |
221 |
1275 |
|
|
21 |
A |
358 |
347 |
0.969 |
221 |
1276 |
|
|
22 |
A |
255 |
243 |
0.953 |
221 |
1277 |
|
|
23 |
A |
176 |
170 |
0.966 |
221 |
1278 |
|
|
24 |
A |
118 |
113 |
0.956 |
221 |
1279 |
CH3SO2NH2 |
methanesulfonamide |
1 |
A' |
3487 |
3245 |
0.931 |
222 |
1280 |
|
|
2 |
A' |
3213 |
3020 |
0.940 |
222 |
1281 |
|
|
3 |
A' |
3094 |
2940 |
0.950 |
222 |
1282 |
|
|
4 |
A' |
1580 |
1576 |
0.997 |
222 |
1283 |
|
|
5 |
A' |
1442 |
1419 |
0.984 |
222 |
1284 |
|
|
6 |
A' |
1333 |
1333 |
1.000 |
222 |
1285 |
|
|
7 |
A' |
1109 |
1145 |
1.032 |
222 |
1286 |
|
|
8 |
A' |
975 |
989 |
1.014 |
222 |
1287 |
|
|
9 |
A' |
899 |
881 |
0.980 |
222 |
1288 |
|
|
10 |
A' |
733 |
778 |
1.061 |
222 |
1289 |
|
|
11 |
A' |
690 |
689 |
0.998 |
222 |
1290 |
|
|
12 |
A' |
474 |
533 |
1.125 |
222 |
1291 |
|
|
13 |
A' |
451 |
493 |
1.094 |
222 |
1292 |
|
|
14 |
A' |
287 |
318 |
1.107 |
222 |
1293 |
|
|
15 |
A" |
3595 |
3320 |
0.923 |
222 |
1294 |
|
|
16 |
A" |
3221 |
3020 |
0.937 |
222 |
1295 |
|
|
18 |
A" |
1325 |
1315 |
0.992 |
222 |
1296 |
|
|
19 |
A" |
1099 |
1166 |
1.061 |
222 |
1297 |
|
|
20 |
A" |
958 |
960 |
1.002 |
222 |
1298 |
|
|
21 |
A" |
377 |
429 |
1.138 |
222 |
1299 |
C3H8 |
Propane |
1 |
A1 |
3137 |
2977 |
0.949 |
223 |
1300 |
|
|
2 |
A1 |
3054 |
2962 |
0.970 |
223 |
1301 |
|
|
3 |
A1 |
3051 |
2887 |
0.946 |
223 |
1302 |
|
|
4 |
A1 |
1504 |
1476 |
0.982 |
223 |
1303 |
|
|
5 |
A1 |
1481 |
1462 |
0.987 |
223 |
1304 |
|
|
6 |
A1 |
1418 |
1392 |
0.982 |
223 |
1305 |
|
|
7 |
A1 |
1181 |
1158 |
0.981 |
223 |
1306 |
|
|
8 |
A1 |
893 |
869 |
0.973 |
223 |
1307 |
|
|
9 |
A1 |
367 |
369 |
1.005 |
223 |
1308 |
|
|
10 |
A2 |
3125 |
2967 |
0.950 |
223 |
1309 |
|
|
11 |
A2 |
1479 |
1451 |
0.981 |
223 |
1310 |
|
|
12 |
A2 |
1318 |
1278 |
0.969 |
223 |
1311 |
|
|
13 |
A2 |
910 |
940 |
1.033 |
223 |
1312 |
|
|
14 |
A2 |
230 |
216 |
0.941 |
223 |
1313 |
|
|
15 |
B1 |
3134 |
2973 |
0.949 |
223 |
1314 |
|
|
16 |
B1 |
3085 |
2968 |
0.962 |
223 |
1315 |
|
|
17 |
B1 |
1497 |
1472 |
0.983 |
223 |
1316 |
|
|
18 |
B1 |
1214 |
1192 |
0.982 |
223 |
1317 |
|
|
19 |
B1 |
757 |
748 |
0.988 |
223 |
1318 |
|
|
20 |
B1 |
284 |
268 |
0.944 |
223 |
1319 |
|
|
21 |
B2 |
3134 |
2968 |
0.947 |
223 |
1320 |
|
|
22 |
B2 |
3050 |
2887 |
0.947 |
223 |
1321 |
|
|
23 |
B2 |
1489 |
1464 |
0.984 |
223 |
1322 |
|
|
24 |
B2 |
1407 |
1378 |
0.979 |
223 |
1323 |
|
|
25 |
B2 |
1365 |
1338 |
0.980 |
223 |
1324 |
|
|
26 |
B2 |
1085 |
1054 |
0.972 |
223 |
1325 |
|
|
27 |
B2 |
933 |
922 |
0.989 |
223 |
1326 |
C5H6 |
Propellane |
1 |
A1' |
3154 |
3029 |
0.960 |
224 |
1327 |
|
|
2 |
A1' |
1529 |
1502 |
0.983 |
224 |
1328 |
|
|
3 |
A1' |
1151 |
1124 |
0.977 |
224 |
1329 |
|
|
4 |
A1' |
915 |
908 |
0.992 |
224 |
1330 |
|
|
8 |
A2" |
1123 |
1124 |
1.000 |
224 |
1331 |
|
|
9 |
A2" |
632 |
615 |
0.973 |
224 |
1332 |
|
|
10 |
E' |
3248 |
3080 |
0.948 |
224 |
1333 |
|
|
11 |
E' |
3150 |
3020 |
0.959 |
224 |
1334 |
|
|
12 |
E' |
1479 |
1459 |
0.987 |
224 |
1335 |
|
|
13 |
E' |
1222 |
1186 |
0.971 |
224 |
1336 |
|
|
14 |
E' |
1104 |
1083 |
0.981 |
224 |
1337 |
|
|
15 |
E' |
531 |
529 |
0.996 |
224 |
1338 |
|
|
16 |
E" |
1149 |
1146 |
0.997 |
224 |
1339 |
|
|
17 |
E" |
1073 |
1064 |
0.991 |
224 |
1340 |
|
|
18 |
E" |
735 |
714 |
0.971 |
224 |
1341 |
CH3CHFCH3 |
2-Fluoropropane |
1 |
A' |
3162 |
2996 |
0.948 |
225 |
1342 |
|
|
2 |
A' |
3157 |
2989 |
0.947 |
225 |
1343 |
|
|
3 |
A' |
3069 |
2954 |
0.962 |
225 |
1344 |
|
|
4 |
A' |
3061 |
2932 |
0.958 |
225 |
1345 |
|
|
5 |
A' |
1501 |
1473 |
0.981 |
225 |
1346 |
|
|
6 |
A' |
1479 |
1465 |
0.991 |
225 |
1347 |
|
|
7 |
A' |
1413 |
1402 |
0.992 |
225 |
1348 |
|
|
8 |
A' |
1374 |
1338 |
0.974 |
225 |
1349 |
|
|
9 |
A' |
1203 |
1183 |
0.984 |
225 |
1350 |
|
|
10 |
A' |
1156 |
1149 |
0.994 |
225 |
1351 |
|
|
11 |
A' |
965 |
918 |
0.952 |
225 |
1352 |
|
|
12 |
A' |
834 |
817 |
0.980 |
225 |
1353 |
|
|
13 |
A' |
477 |
480 |
1.007 |
225 |
1354 |
|
|
14 |
A' |
351 |
357 |
1.018 |
225 |
1355 |
|
|
15 |
A' |
262 |
262 |
0.998 |
225 |
1356 |
|
|
16 |
A" |
3160 |
2996 |
0.948 |
225 |
1357 |
|
|
17 |
A" |
3150 |
2989 |
0.949 |
225 |
1358 |
|
|
18 |
A" |
3065 |
2932 |
0.957 |
225 |
1359 |
|
|
19 |
A" |
1476 |
1448 |
0.981 |
225 |
1360 |
|
|
20 |
A" |
1470 |
1450 |
0.987 |
225 |
1361 |
|
|
21 |
A" |
1415 |
1385 |
0.979 |
225 |
1362 |
|
|
22 |
A" |
1371 |
1345 |
0.981 |
225 |
1363 |
|
|
23 |
A" |
1174 |
1104 |
0.940 |
225 |
1364 |
|
|
24 |
A" |
943 |
941 |
0.998 |
225 |
1365 |
|
|
25 |
A" |
931 |
928 |
0.996 |
225 |
1366 |
|
|
26 |
A" |
405 |
415 |
1.025 |
225 |
1367 |
|
|
27 |
A" |
217 |
243 |
1.120 |
225 |
1368 |
CH2FCH2CH3 |
1-Fluoropropane |
1 |
A |
3161 |
2991 |
0.946 |
226 |
1369 |
|
|
2 |
A |
3142 |
2973 |
0.946 |
226 |
1370 |
|
|
3 |
A |
3117 |
2963 |
0.951 |
226 |
1371 |
|
|
4 |
A |
3102 |
2953 |
0.952 |
226 |
1372 |
|
|
5 |
A |
3064 |
2941 |
0.960 |
226 |
1373 |
|
|
6 |
A |
3061 |
2907 |
0.950 |
226 |
1374 |
|
|
7 |
A |
3054 |
2902 |
0.950 |
226 |
1375 |
|
|
8 |
A |
1506 |
1481 |
0.984 |
226 |
1376 |
|
|
9 |
A |
1500 |
1474 |
0.982 |
226 |
1377 |
|
|
10 |
A |
1484 |
1467 |
0.988 |
226 |
1378 |
|
|
11 |
A |
1467 |
1441 |
0.982 |
226 |
1379 |
|
|
12 |
A |
1430 |
1398 |
0.978 |
226 |
1380 |
|
|
13 |
A |
1412 |
1398 |
0.990 |
226 |
1381 |
|
|
13 |
A' |
1056 |
1391 |
1.318 |
226 |
1382 |
|
|
14 |
A |
1378 |
1345 |
0.976 |
226 |
1383 |
|
|
15 |
A |
1305 |
1279 |
0.980 |
226 |
1384 |
|
|
16 |
A |
1273 |
1254 |
0.985 |
226 |
1385 |
|
|
17 |
A |
1180 |
1159 |
0.982 |
226 |
1386 |
|
|
18 |
A |
1128 |
1106 |
0.980 |
226 |
1387 |
|
|
19 |
A |
1103 |
1072 |
0.972 |
226 |
1388 |
|
|
20 |
A |
987 |
966 |
0.978 |
226 |
1389 |
|
|
21 |
A |
924 |
917 |
0.992 |
226 |
1390 |
|
|
22 |
A |
891 |
867 |
0.973 |
226 |
1391 |
|
|
22 |
A" |
1270 |
890 |
0.701 |
226 |
1392 |
|
|
23 |
A |
775 |
761 |
0.981 |
226 |
1393 |
|
|
24 |
A |
481 |
478 |
0.993 |
226 |
1394 |
|
|
25 |
A |
319 |
315 |
0.989 |
226 |
1395 |
|
|
26 |
A |
228 |
213 |
0.933 |
226 |
1396 |
|
|
26 |
A" |
241 |
210 |
0.872 |
226 |
1397 |
|
|
27 |
A" |
131 |
129 |
0.988 |
226 |
1398 |
|
|
27 |
A |
148 |
141 |
0.955 |
226 |
1399 |
C6H6 |
Benzvalene |
1 |
A1 |
3276 |
3103 |
0.947 |
227 |
1400 |
|
|
2 |
A1 |
3244 |
3081 |
0.950 |
227 |
1401 |
|
|
3 |
A1 |
3216 |
2995 |
0.931 |
227 |
1402 |
|
|
4 |
A1 |
1616 |
1556 |
0.963 |
227 |
1403 |
|
|
5 |
A1 |
1414 |
1376 |
0.973 |
227 |
1404 |
|
|
6 |
A1 |
1192 |
1367 |
1.146 |
227 |
1405 |
|
|
7 |
A1 |
1109 |
1163 |
1.049 |
227 |
1406 |
|
|
8 |
A1 |
987 |
1090 |
1.104 |
227 |
1407 |
|
|
9 |
A1 |
914 |
972 |
1.064 |
227 |
1408 |
|
|
10 |
A1 |
763 |
996 |
1.305 |
227 |
1409 |
|
|
11 |
A1 |
680 |
656 |
0.965 |
227 |
1410 |
|
|
12 |
A2 |
1113 |
1094 |
0.983 |
227 |
1411 |
|
|
13 |
A2 |
911 |
910 |
0.999 |
227 |
1412 |
|
|
14 |
A2 |
886 |
800 |
0.903 |
227 |
1413 |
|
|
15 |
A2 |
780 |
774 |
0.992 |
227 |
1414 |
|
|
16 |
A2 |
542 |
536 |
0.989 |
227 |
1415 |
|
|
17 |
B1 |
3225 |
3086 |
0.957 |
227 |
1416 |
|
|
18 |
B1 |
1121 |
1101 |
0.982 |
227 |
1417 |
|
|
19 |
B1 |
994 |
761 |
0.766 |
227 |
1418 |
|
|
20 |
B1 |
759 |
742 |
0.977 |
227 |
1419 |
|
|
21 |
B1 |
634 |
628 |
0.991 |
227 |
1420 |
|
|
22 |
B1 |
513 |
500 |
0.974 |
227 |
1421 |
|
|
23 |
B2 |
3250 |
3085 |
0.949 |
227 |
1422 |
|
|
24 |
B2 |
3218 |
3071 |
0.954 |
227 |
1423 |
|
|
25 |
B2 |
1342 |
1315 |
0.980 |
227 |
1424 |
|
|
26 |
B2 |
1269 |
1241 |
0.978 |
227 |
1425 |
|
|
27 |
B2 |
1213 |
1184 |
0.976 |
227 |
1426 |
|
|
28 |
B2 |
984 |
975 |
0.991 |
227 |
1427 |
|
|
29 |
B2 |
861 |
850 |
0.987 |
227 |
1428 |
|
|
30 |
B2 |
822 |
812 |
0.988 |
227 |
1429 |
C6H6 |
Trimethylenecycopropane |
1 |
A1' |
3169 |
3000 |
0.947 |
228 |
1430 |
|
|
2 |
A1' |
1896 |
1800 |
0.949 |
228 |
1431 |
|
|
3 |
A1' |
1471 |
1422 |
0.967 |
228 |
1432 |
|
|
4 |
A1' |
798 |
779 |
0.976 |
228 |
1433 |
|
|
9 |
A2" |
894 |
885 |
0.990 |
228 |
1434 |
|
|
10 |
A2" |
214 |
212 |
0.990 |
228 |
1435 |
|
|
11 |
E' |
3271 |
3095 |
0.946 |
228 |
1436 |
|
|
12 |
E' |
3169 |
2994 |
0.945 |
228 |
1437 |
|
|
13 |
E' |
1687 |
1620 |
0.960 |
228 |
1438 |
|
|
14 |
E' |
1438 |
1398 |
0.972 |
228 |
1439 |
|
|
15 |
E' |
1127 |
1108 |
0.983 |
228 |
1440 |
|
|
16 |
E' |
800 |
779 |
0.974 |
228 |
1441 |
|
|
17 |
E' |
221 |
235 |
1.063 |
228 |
1442 |
|
|
18 |
E" |
888 |
873 |
0.984 |
228 |
1443 |
|
|
20 |
E" |
345 |
340 |
0.986 |
228 |
1444 |
C4H8 |
cyclobutane |
1 |
A1 |
3121 |
2951 |
0.946 |
229 |
1445 |
|
|
2 |
A1 |
3084 |
2862 |
0.928 |
229 |
1446 |
|
|
3 |
A1 |
1513 |
1468 |
0.971 |
229 |
1447 |
|
|
4 |
A1 |
1176 |
1153 |
0.980 |
229 |
1448 |
|
|
5 |
A1 |
1036 |
1004 |
0.969 |
229 |
1449 |
|
|
6 |
A1 |
211 |
199 |
0.944 |
229 |
1450 |
|
|
7 |
A2 |
1252 |
1260 |
1.007 |
229 |
1451 |
|
|
8 |
A2 |
962 |
941 |
0.978 |
229 |
1452 |
|
|
9 |
B1 |
1265 |
1231 |
0.973 |
229 |
1453 |
|
|
10 |
B1 |
1166 |
1142 |
0.979 |
229 |
1454 |
|
|
11 |
B1 |
955 |
928 |
0.972 |
229 |
1455 |
|
|
12 |
B2 |
3150 |
2973 |
0.944 |
229 |
1456 |
|
|
13 |
B2 |
3073 |
2934 |
0.955 |
229 |
1457 |
|
|
14 |
B2 |
1474 |
1440 |
0.976 |
229 |
1458 |
|
|
15 |
B2 |
900 |
883 |
0.981 |
229 |
1459 |
|
|
16 |
B2 |
631 |
625 |
0.991 |
229 |
1460 |
|
|
17 |
E |
3134 |
2959 |
0.944 |
229 |
1461 |
|
|
18 |
E |
3075 |
2862 |
0.931 |
229 |
1462 |
|
|
19 |
E |
1468 |
1441 |
0.981 |
229 |
1463 |
|
|
20 |
E |
1293 |
1252 |
0.968 |
229 |
1464 |
|
|
21 |
E |
1250 |
1217 |
0.974 |
229 |
1465 |
|
|
22 |
E |
926 |
893 |
0.964 |
229 |
1466 |
|
|
23 |
E |
755 |
746 |
0.987 |
229 |
1467 |
CH3CH2CH2CN |
Butanenitrile |
1 |
A' |
3149 |
2977 |
0.945 |
230 |
1468 |
|
|
2 |
A' |
3078 |
2895 |
0.941 |
230 |
1469 |
|
|
3 |
A' |
3069 |
2888 |
0.941 |
230 |
1470 |
|
|
4 |
A' |
3059 |
2883 |
0.942 |
230 |
1471 |
|
|
5 |
A' |
2293 |
2263 |
0.987 |
230 |
1472 |
|
|
6 |
A' |
1499 |
1472 |
0.982 |
230 |
1473 |
|
|
7 |
A' |
1485 |
1457 |
0.981 |
230 |
1474 |
|
|
8 |
A' |
1462 |
1438 |
0.983 |
230 |
1475 |
|
|
9 |
A' |
1417 |
1393 |
0.983 |
230 |
1476 |
|
|
10 |
A' |
1391 |
1346 |
0.968 |
230 |
1477 |
|
|
11 |
A' |
1301 |
1334 |
1.025 |
230 |
1478 |
|
|
12 |
A' |
1122 |
1100 |
0.980 |
230 |
1479 |
|
|
13 |
A' |
1071 |
1053 |
0.983 |
230 |
1480 |
|
|
14 |
A' |
971 |
920 |
0.948 |
230 |
1481 |
|
|
15 |
A' |
889 |
842 |
0.948 |
230 |
1482 |
|
|
16 |
A' |
528 |
551 |
1.044 |
230 |
1483 |
|
|
17 |
A' |
348 |
358 |
1.028 |
230 |
1484 |
|
|
18 |
A' |
165 |
|
|
230 |
1485 |
|
|
19 |
A" |
3143 |
2986 |
0.950 |
230 |
1486 |
|
|
20 |
A" |
3124 |
2964 |
0.949 |
230 |
1487 |
|
|
21 |
A" |
3107 |
2950 |
0.950 |
230 |
1488 |
|
|
22 |
A" |
1490 |
1469 |
0.986 |
230 |
1489 |
|
|
23 |
A" |
1328 |
1267 |
0.954 |
230 |
1490 |
|
|
24 |
A" |
1260 |
1234 |
0.979 |
230 |
1491 |
|
|
25 |
A" |
1128 |
1083 |
0.960 |
230 |
1492 |
|
|
26 |
A" |
875 |
871 |
0.995 |
230 |
1493 |
|
|
27 |
A" |
753 |
764 |
1.015 |
230 |
1494 |
|
|
28 |
A" |
384 |
370 |
0.964 |
230 |
1495 |
|
|
29 |
A" |
254 |
|
|
230 |
1496 |
|
|
30 |
A" |
102 |
|
|
230 |
1497 |
CH3OC2H5 |
Ethane, methoxy- |
1 |
A' |
3157 |
2995 |
0.949 |
231 |
1498 |
|
|
2 |
A' |
3155 |
2968 |
0.941 |
231 |
1499 |
|
|
3 |
A' |
3070 |
2954 |
0.962 |
231 |
1500 |
|
|
4 |
A' |
2995 |
2835 |
0.946 |
231 |
1501 |
|
|
5 |
A' |
2976 |
2869 |
0.964 |
231 |
1502 |
|
|
6 |
A' |
1526 |
1492 |
0.978 |
231 |
1503 |
|
|
7 |
A' |
1498 |
1481 |
0.989 |
231 |
1504 |
|
|
8 |
A' |
1493 |
1473 |
0.987 |
231 |
1505 |
|
|
9 |
A' |
1473 |
1448 |
0.983 |
231 |
1506 |
|
|
10 |
A' |
1429 |
1396 |
0.977 |
231 |
1507 |
|
|
11 |
A' |
1390 |
1368 |
0.984 |
231 |
1508 |
|
|
12 |
A' |
1240 |
1214 |
0.979 |
231 |
1509 |
|
|
13 |
A' |
1179 |
1135 |
0.963 |
231 |
1510 |
|
|
14 |
A' |
1119 |
1100 |
0.983 |
231 |
1511 |
|
|
15 |
A' |
1051 |
1020 |
0.970 |
231 |
1512 |
|
|
16 |
A' |
879 |
858 |
0.976 |
231 |
1513 |
|
|
17 |
A' |
469 |
475 |
1.012 |
231 |
1514 |
|
|
18 |
A' |
288 |
288 |
1.000 |
231 |
1515 |
|
|
19 |
A" |
3161 |
2981 |
0.943 |
231 |
1516 |
|
|
20 |
A" |
3047 |
2935 |
0.963 |
231 |
1517 |
|
|
21 |
A" |
3011 |
2893 |
0.961 |
231 |
1518 |
|
|
22 |
A" |
1474 |
1464 |
0.993 |
231 |
1519 |
|
|
23 |
A" |
1471 |
1456 |
0.990 |
231 |
1520 |
|
|
24 |
A" |
1296 |
1277 |
0.985 |
231 |
1521 |
|
|
25 |
A" |
1200 |
1175 |
0.980 |
231 |
1522 |
|
|
26 |
A" |
1164 |
1148 |
0.986 |
231 |
1523 |
|
|
27 |
A" |
827 |
818 |
0.989 |
231 |
1524 |
|
|
28 |
A" |
270 |
278 |
1.029 |
231 |
1525 |
|
|
29 |
A" |
215 |
248 |
1.152 |
231 |
1526 |
|
|
30 |
A" |
115 |
115 |
1.000 |
231 |
1527 |
CH2ClCHCHCH3 |
2-Butene, 1-chloro- |
1 |
A |
3186 |
3035 |
0.952 |
232 |
1528 |
|
|
2 |
A |
3171 |
3012 |
0.950 |
232 |
1529 |
|
|
3 |
A |
3163 |
2967 |
0.938 |
232 |
1530 |
|
|
4 |
A |
3146 |
2954 |
0.939 |
232 |
1531 |
|
|
5 |
A |
3117 |
2938 |
0.943 |
232 |
1532 |
|
|
6 |
A |
3107 |
2916 |
0.938 |
232 |
1533 |
|
|
7 |
A |
3052 |
2898 |
0.950 |
232 |
1534 |
|
|
8 |
A |
1743 |
1675 |
0.961 |
232 |
1535 |
|
|
9 |
A |
1480 |
1459 |
0.986 |
232 |
1536 |
|
|
10 |
A |
1472 |
1446 |
0.982 |
232 |
1537 |
|
|
11 |
A |
1468 |
1434 |
0.977 |
232 |
1538 |
|
|
12 |
A |
1409 |
1383 |
0.981 |
232 |
1539 |
|
|
13 |
A |
1334 |
1312 |
0.984 |
232 |
1540 |
|
|
14 |
A |
1324 |
1305 |
0.986 |
232 |
1541 |
|
|
15 |
A |
1268 |
1253 |
0.988 |
232 |
1542 |
|
|
16 |
A |
1203 |
1180 |
0.981 |
232 |
1543 |
|
|
17 |
A |
1119 |
1102 |
0.984 |
232 |
1544 |
|
|
18 |
A |
1111 |
1076 |
0.968 |
232 |
1545 |
|
|
19 |
A |
1063 |
1044 |
0.982 |
232 |
1546 |
|
|
20 |
A |
1002 |
966 |
0.964 |
232 |
1547 |
|
|
21 |
A |
951 |
942 |
0.991 |
232 |
1548 |
|
|
22 |
A |
892 |
878 |
0.985 |
232 |
1549 |
|
|
23 |
A |
799 |
782 |
0.978 |
232 |
1550 |
|
|
24 |
A |
692 |
690 |
0.997 |
232 |
1551 |
|
|
25 |
A |
493 |
491 |
0.997 |
232 |
1552 |
|
|
26 |
A |
356 |
350 |
0.984 |
232 |
1553 |
|
|
27 |
A |
277 |
283 |
1.021 |
232 |
1554 |
|
|
28 |
A |
214 |
195 |
0.913 |
232 |
1555 |
|
|
29 |
A |
160 |
151 |
0.946 |
232 |
1556 |
|
|
30 |
A |
88 |
82 |
0.929 |
232 |
1557 |
C6H4Cl2 |
1,4-dichlorobenzene |
1 |
Ag |
3247 |
3072 |
0.946 |
233 |
1558 |
|
|
2 |
Ag |
1636 |
1574 |
0.962 |
233 |
1559 |
|
|
3 |
Ag |
1188 |
1169 |
0.984 |
233 |
1560 |
|
|
4 |
Ag |
1122 |
1096 |
0.977 |
233 |
1561 |
|
|
5 |
Ag |
758 |
747 |
0.986 |
233 |
1562 |
|
|
6 |
Ag |
331 |
328 |
0.990 |
233 |
1563 |
|
|
7 |
Au |
971 |
951 |
0.979 |
233 |
1564 |
|
|
8 |
Au |
419 |
405 |
0.967 |
233 |
1565 |
|
|
9 |
B1g |
833 |
815 |
0.978 |
233 |
1566 |
|
|
10 |
B1u |
3231 |
3078 |
0.953 |
233 |
1567 |
|
|
11 |
B1u |
1507 |
1477 |
0.980 |
233 |
1568 |
|
|
12 |
B1u |
1113 |
1090 |
0.979 |
233 |
1569 |
|
|
13 |
B1u |
1023 |
1015 |
0.992 |
233 |
1570 |
|
|
14 |
B1u |
552 |
550 |
0.997 |
233 |
1571 |
|
|
15 |
B2g |
950 |
934 |
0.984 |
233 |
1572 |
|
|
16 |
B2g |
684 |
687 |
1.004 |
233 |
1573 |
|
|
17 |
B2g |
298 |
298 |
1.000 |
233 |
1574 |
|
|
18 |
B2u |
3246 |
3087 |
0.951 |
233 |
1575 |
|
|
19 |
B2u |
1427 |
1394 |
0.977 |
233 |
1576 |
|
|
20 |
B2u |
1358 |
1220 |
0.898 |
233 |
1577 |
|
|
21 |
B2u |
1117 |
1107 |
0.991 |
233 |
1578 |
|
|
22 |
B2u |
221 |
226 |
1.024 |
233 |
1579 |
|
|
23 |
B3g |
3233 |
3065 |
0.948 |
233 |
1580 |
|
|
24 |
B3g |
1629 |
1574 |
0.966 |
233 |
1581 |
|
|
25 |
B3g |
1303 |
1290 |
0.990 |
233 |
1582 |
|
|
26 |
B3g |
637 |
626 |
0.983 |
233 |
1583 |
|
|
27 |
B3g |
354 |
350 |
0.988 |
233 |
1584 |
|
|
28 |
B3u |
834 |
819 |
0.982 |
233 |
1585 |
|
|
29 |
B3u |
493 |
485 |
0.983 |
233 |
1586 |
|
|
30 |
B3u |
103 |
122 |
1.190 |
233 |
1587 |
B4H10 |
Tetraborane(10) |
1 |
A1 |
2720 |
2570 |
0.945 |
234 |
1588 |
|
|
2 |
A1 |
2699 |
2570 |
0.952 |
234 |
1589 |
|
|
3 |
A1 |
2605 |
2475 |
0.950 |
234 |
1590 |
|
|
4 |
A1 |
2249 |
2095 |
0.932 |
234 |
1591 |
|
|
5 |
A1 |
1575 |
1444 |
0.917 |
234 |
1592 |
|
|
6 |
A1 |
1174 |
1255 |
1.069 |
234 |
1593 |
|
|
7 |
A1 |
994 |
1145 |
1.152 |
234 |
1594 |
|
|
8 |
A1 |
854 |
965 |
1.130 |
234 |
1595 |
|
|
9 |
A1 |
801 |
908 |
1.134 |
234 |
1596 |
|
|
10 |
A1 |
672 |
827 |
1.231 |
234 |
1597 |
|
|
11 |
A1 |
563 |
785 |
1.394 |
234 |
1598 |
|
|
12 |
A1 |
216 |
559 |
2.583 |
234 |
1599 |
|
|
13 |
A2 |
2281 |
2150 |
0.942 |
234 |
1600 |
|
|
14 |
A2 |
1477 |
1308 |
0.886 |
234 |
1601 |
|
|
15 |
A2 |
1067 |
1117 |
1.047 |
234 |
1602 |
|
|
16 |
A2 |
1024 |
1023 |
0.999 |
234 |
1603 |
|
|
17 |
A2 |
901 |
868 |
0.963 |
234 |
1604 |
|
|
18 |
A2 |
683 |
737 |
1.080 |
234 |
1605 |
|
|
19 |
A2 |
412 |
662 |
1.606 |
234 |
1606 |
|
|
20 |
B1 |
2710 |
2570 |
0.948 |
234 |
1607 |
|
|
21 |
B1 |
2251 |
2150 |
0.955 |
234 |
1608 |
|
|
22 |
B1 |
1540 |
1324 |
0.860 |
234 |
1609 |
|
|
23 |
B1 |
1085 |
1196 |
1.103 |
234 |
1610 |
|
|
24 |
B1 |
995 |
966 |
0.971 |
234 |
1611 |
|
|
25 |
B1 |
907 |
846 |
0.933 |
234 |
1612 |
|
|
28 |
B2 |
2700 |
2570 |
0.952 |
234 |
1613 |
|
|
29 |
B2 |
2601 |
2475 |
0.952 |
234 |
1614 |
|
|
30 |
B2 |
2269 |
2150 |
0.947 |
234 |
1615 |
|
|
31 |
B2 |
1329 |
1388 |
1.045 |
234 |
1616 |
|
|
32 |
B2 |
1157 |
1140 |
0.986 |
234 |
1617 |
|
|
33 |
B2 |
935 |
1064 |
1.138 |
234 |
1618 |
|
|
34 |
B2 |
877 |
898 |
1.024 |
234 |
1619 |
|
|
35 |
B2 |
486 |
472 |
0.971 |
234 |
1620 |
|
|
36 |
B2 |
350 |
236 |
0.674 |
234 |
1621 |
B5H9 |
pentaborane9 |
1 |
A1 |
2743 |
2628 |
0.958 |
235 |
1622 |
|
|
2 |
A1 |
2728 |
2610 |
0.957 |
235 |
1623 |
|
|
3 |
A1 |
2014 |
1844 |
0.916 |
235 |
1624 |
|
|
4 |
A1 |
1155 |
1126 |
0.975 |
235 |
1625 |
|
|
5 |
A1 |
1008 |
985 |
0.977 |
235 |
1626 |
|
|
6 |
A1 |
814 |
799 |
0.981 |
235 |
1627 |
|
|
7 |
A1 |
711 |
702 |
0.987 |
235 |
1628 |
|
|
12 |
B1 |
763 |
741 |
0.971 |
235 |
1629 |
|
|
13 |
B1 |
615 |
240 |
0.390 |
235 |
1630 |
|
|
14 |
B2 |
2716 |
2610 |
0.961 |
235 |
1631 |
|
|
16 |
B2 |
801 |
1036 |
1.294 |
235 |
1632 |
|
|
17 |
B2 |
712 |
785 |
1.103 |
235 |
1633 |
|
|
18 |
B2 |
473 |
600 |
1.269 |
235 |
1634 |
|
|
19 |
E |
2724 |
2610 |
0.958 |
235 |
1635 |
|
|
20 |
E |
1973 |
1800 |
0.913 |
235 |
1636 |
|
|
21 |
E |
1561 |
1634 |
1.047 |
235 |
1637 |
|
|
22 |
E |
1073 |
1409 |
1.313 |
235 |
1638 |
|
|
23 |
E |
945 |
1036 |
1.097 |
235 |
1639 |
|
|
24 |
E |
904 |
892 |
0.987 |
235 |
1640 |
|
|
25 |
E |
798 |
710 |
0.890 |
235 |
1641 |
|
|
26 |
E |
633 |
618 |
0.976 |
235 |
1642 |
CH3CH2CH2CH3 |
Butane |
|
Ag |
428 |
1442 |
3.371 |
236 |
1643 |
|
|
|
Ag |
855 |
1151 |
1.346 |
236 |
1644 |
|
|
|
Au |
1291 |
1257 |
0.974 |
236 |
1645 |
|
|
|
Bg |
1488 |
1300 |
0.874 |
236 |
1646 |
|
|
|
Bu |
3044 |
2870 |
0.943 |
236 |
1647 |
|
|
|
Bu |
3052 |
2853 |
0.935 |
236 |
1648 |
|
|
|
Bu |
3137 |
271 |
0.086 |
236 |
1649 |
C5H8O |
Methyl cyclopropyl ketone |
1 |
A' |
3274 |
3106 |
0.949 |
237 |
1650 |
|
|
2 |
A' |
3198 |
3054 |
0.955 |
237 |
1651 |
|
|
3 |
A' |
3189 |
3023 |
0.948 |
237 |
1652 |
|
|
4 |
A' |
3165 |
2970 |
0.938 |
237 |
1653 |
|
|
5 |
A' |
3060 |
2929 |
0.957 |
237 |
1654 |
|
|
6 |
A' |
1772 |
1725 |
0.973 |
237 |
1655 |
|
|
7 |
A' |
1489 |
1458 |
0.979 |
237 |
1656 |
|
|
8 |
A' |
1452 |
1441 |
0.993 |
237 |
1657 |
|
|
9 |
A' |
1418 |
1386 |
0.977 |
237 |
1658 |
|
|
10 |
A' |
1371 |
1352 |
0.986 |
237 |
1659 |
|
|
11 |
A' |
1228 |
1201 |
0.978 |
237 |
1660 |
|
|
12 |
A' |
1199 |
1170 |
0.976 |
237 |
1661 |
|
|
13 |
A' |
1109 |
1096 |
0.988 |
237 |
1662 |
|
|
14 |
A' |
1060 |
1038 |
0.979 |
237 |
1663 |
|
|
15 |
A' |
974 |
958 |
0.984 |
237 |
1664 |
|
|
16 |
A' |
931 |
900 |
0.967 |
237 |
1665 |
|
|
17 |
A' |
808 |
808 |
1.000 |
237 |
1666 |
|
|
18 |
A' |
757 |
748 |
0.989 |
237 |
1667 |
|
|
19 |
A' |
592 |
587 |
0.991 |
237 |
1668 |
|
|
20 |
A' |
375 |
385 |
1.027 |
237 |
1669 |
|
|
21 |
A' |
243 |
246 |
1.011 |
237 |
1670 |
|
|
22 |
A" |
3261 |
3086 |
0.946 |
237 |
1671 |
|
|
23 |
A" |
3162 |
3017 |
0.954 |
237 |
1672 |
|
|
24 |
A" |
3135 |
2966 |
0.946 |
237 |
1673 |
|
|
25 |
A" |
1466 |
1487 |
1.014 |
237 |
1674 |
|
|
26 |
A" |
1438 |
1424 |
0.990 |
237 |
1675 |
|
|
27 |
A" |
1208 |
1176 |
0.974 |
237 |
1676 |
|
|
28 |
A" |
1123 |
1112 |
0.990 |
237 |
1677 |
|
|
29 |
A" |
1088 |
1072 |
0.985 |
237 |
1678 |
|
|
30 |
A" |
1047 |
1028 |
0.982 |
237 |
1679 |
|
|
31 |
A" |
880 |
865 |
0.983 |
237 |
1680 |
|
|
32 |
A" |
835 |
822 |
0.985 |
237 |
1681 |
|
|
33 |
A" |
603 |
601 |
0.996 |
237 |
1682 |
|
|
34 |
A" |
259 |
265 |
1.023 |
237 |
1683 |
|
|
35 |
A" |
150 |
125 |
0.832 |
237 |
1684 |
|
|
36 |
A" |
68 |
61 |
0.896 |
237 |
1685 |
C10H8 |
naphthalene |
1 |
Ag |
3226 |
3060 |
0.949 |
238 |
1686 |
|
|
2 |
Ag |
3199 |
3031 |
0.948 |
238 |
1687 |
|
|
3 |
Ag |
1629 |
1577 |
0.968 |
238 |
1688 |
|
|
4 |
Ag |
1490 |
1460 |
0.980 |
238 |
1689 |
|
|
5 |
Ag |
1436 |
1376 |
0.958 |
238 |
1690 |
|
|
6 |
Ag |
1176 |
1145 |
0.974 |
238 |
1691 |
|
|
7 |
Ag |
1051 |
1025 |
0.975 |
238 |
1692 |
|
|
8 |
Ag |
776 |
758 |
0.977 |
238 |
1693 |
|
|
9 |
Ag |
519 |
512 |
0.987 |
238 |
1694 |
|
|
10 |
Au |
981 |
970 |
0.989 |
238 |
1695 |
|
|
11 |
Au |
854 |
841 |
0.985 |
238 |
1696 |
|
|
12 |
Au |
617 |
581 |
0.941 |
238 |
1697 |
|
|
13 |
Au |
187 |
195 |
1.041 |
238 |
1698 |
|
|
14 |
B1g |
955 |
943 |
0.988 |
238 |
1699 |
|
|
15 |
B1g |
733 |
717 |
0.978 |
238 |
1700 |
|
|
16 |
B1g |
393 |
386 |
0.983 |
238 |
1701 |
|
|
17 |
B1u |
3213 |
3065 |
0.954 |
238 |
1702 |
|
|
18 |
B1u |
3193 |
3058 |
0.958 |
238 |
1703 |
|
|
19 |
B1u |
1649 |
1595 |
0.967 |
238 |
1704 |
|
|
20 |
B1u |
1412 |
1389 |
0.983 |
238 |
1705 |
|
|
21 |
B1u |
1281 |
1265 |
0.987 |
238 |
1706 |
|
|
22 |
B1u |
1145 |
1125 |
0.982 |
238 |
1707 |
|
|
23 |
B1u |
806 |
753 |
0.935 |
238 |
1708 |
|
|
24 |
B1u |
362 |
359 |
0.992 |
238 |
1709 |
|
|
25 |
B2g |
987 |
980 |
0.992 |
238 |
1710 |
|
|
26 |
B2g |
884 |
876 |
0.991 |
238 |
1711 |
|
|
27 |
B2g |
745 |
770 |
1.034 |
238 |
1712 |
|
|
28 |
B2g |
476 |
461 |
0.968 |
238 |
1713 |
|
|
29 |
B2u |
3225 |
3090 |
0.958 |
238 |
1714 |
|
|
30 |
B2u |
3196 |
3027 |
0.947 |
238 |
1715 |
|
|
31 |
B2u |
1560 |
1506 |
0.966 |
238 |
1716 |
|
|
32 |
B2u |
1423 |
1361 |
0.956 |
238 |
1717 |
|
|
33 |
B2u |
1242 |
1209 |
0.973 |
238 |
1718 |
|
|
34 |
B2u |
1168 |
1138 |
0.974 |
238 |
1719 |
|
|
35 |
B2u |
1042 |
1008 |
0.968 |
238 |
1720 |
|
|
36 |
B2u |
629 |
618 |
0.983 |
238 |
1721 |
|
|
37 |
B3g |
3212 |
3092 |
0.963 |
238 |
1722 |
|
|
38 |
B3g |
3192 |
3060 |
0.959 |
238 |
1723 |
|
|
39 |
B3g |
1690 |
1624 |
0.961 |
238 |
1724 |
|
|
40 |
B3g |
1492 |
1438 |
0.964 |
238 |
1725 |
|
|
41 |
B3g |
1262 |
1239 |
0.981 |
238 |
1726 |
|
|
42 |
B3g |
1167 |
1158 |
0.992 |
238 |
1727 |
|
|
43 |
B3g |
943 |
935 |
0.991 |
238 |
1728 |
|
|
44 |
B3g |
514 |
506 |
0.984 |
238 |
1729 |
|
|
45 |
B3u |
969 |
958 |
0.989 |
238 |
1730 |
|
|
46 |
B3u |
801 |
782 |
0.976 |
238 |
1731 |
|
|
47 |
B3u |
485 |
476 |
0.981 |
238 |
1732 |
|
|
48 |
B3u |
173 |
176 |
1.015 |
238 |
1733 |