H2 |
Hydrogen diatomic |
1 |
Σg |
4171 |
4161 |
0.998 |
1 |
1 |
LiH |
Lithium Hydride |
1 |
Σ |
1384 |
1360 |
0.983 |
2 |
2 |
Li2 |
Lithium diatomic |
1 |
Σg |
342 |
346 |
1.012 |
3 |
3 |
NaH |
sodium hydride |
1 |
Σ |
1170 |
1133 |
0.968 |
4 |
4 |
Na2 |
Sodium diatomic |
1 |
Σg |
166 |
158 |
0.949 |
5 |
5 |
BeH |
beryllium monohydride |
1 |
Σ |
1989 |
1987 |
0.999 |
6 |
6 |
MgH |
magnesium monohydride |
1 |
Σ |
1427 |
1432 |
1.004 |
7 |
7 |
BH |
Boron monohydride |
1 |
Σ |
2229 |
2269 |
1.018 |
8 |
8 |
AlH |
aluminum monohydride |
1 |
Σ |
1606 |
1625 |
1.012 |
9 |
9 |
CH |
Methylidyne |
1 |
Σ |
2714 |
2733 |
1.007 |
10 |
10 |
|
|
1 |
Σ |
3033 |
|
|
10 |
11 |
C2 |
Carbon diatomic |
1 |
Σg |
1904 |
1827 |
0.960 |
11 |
12 |
SiH |
Silylidyne |
1 |
Σ |
1953 |
1971 |
1.009 |
12 |
13 |
Si2 |
Silicon diatomic |
1 |
Σg |
476 |
507 |
1.064 |
13 |
14 |
NH |
Imidogen |
1 |
Σ |
3129 |
3126 |
0.999 |
14 |
15 |
CN |
Cyano radical |
1 |
Σ |
2146 |
2042 |
0.952 |
15 |
16 |
N2 |
Nitrogen diatomic |
1 |
Σg |
2405 |
2330 |
0.969 |
16 |
17 |
SiN |
Silicon nitride |
1 |
Σ |
1194 |
1138 |
0.954 |
17 |
18 |
PH |
phosphorus monohydride |
1 |
Σ |
2251 |
2276 |
1.011 |
18 |
19 |
|
|
1 |
Σ |
2262 |
2319 |
1.025 |
18 |
20 |
CP |
Carbon monophosphide |
1 |
Σ |
1284 |
1226 |
0.955 |
19 |
21 |
PN |
Phosphorus mononitride |
1 |
Σ |
1370 |
1323 |
0.966 |
20 |
22 |
P2 |
Phosphorus diatomic |
1 |
Σg |
790 |
775 |
0.981 |
21 |
23 |
OH |
Hydroxyl radical |
1 |
Σ |
3554 |
3570 |
1.004 |
22 |
24 |
LiO |
lithium oxide |
1 |
Σ |
843 |
799 |
0.947 |
23 |
25 |
BeO |
beryllium oxide |
1 |
Σ |
1520 |
1435 |
0.944 |
24 |
26 |
BO |
boron monoxide |
1 |
Σ |
1904 |
1862 |
0.978 |
25 |
27 |
CO |
Carbon monoxide |
1 |
Σ |
2193 |
2143 |
0.977 |
26 |
28 |
|
|
1 |
Σ |
1810 |
|
|
26 |
29 |
NaO |
sodium monoxide |
1 |
Σ |
507 |
|
|
27 |
30 |
MgO |
magnesium oxide |
1 |
Σ |
837 |
775 |
0.926 |
28 |
31 |
SiO |
Silicon monoxide |
1 |
Σ |
1229 |
1230 |
1.001 |
29 |
32 |
HS |
Mercapto radical |
1 |
Σ |
2561 |
2599 |
1.015 |
30 |
33 |
BeS |
beryllium sulfide |
1 |
Σ |
1014 |
986 |
0.972 |
31 |
34 |
BS |
boron sulfide |
1 |
Σ |
1184 |
1167 |
0.986 |
32 |
35 |
CS |
carbon monosulfide |
1 |
Σ |
1289 |
1272 |
0.987 |
33 |
36 |
SO |
Sulfur monoxide |
1 |
Σ |
1107 |
1138 |
1.028 |
34 |
37 |
|
|
1 |
Σ |
1107 |
1054 |
0.952 |
34 |
38 |
MgS |
magnesium sulfide |
1 |
Σ |
542 |
523 |
0.966 |
35 |
39 |
AlS |
Aluminum sulfide |
1 |
Σ |
624 |
610 |
0.978 |
36 |
40 |
SiS |
silicon monosulfide |
1 |
Σ |
734 |
744 |
1.014 |
37 |
41 |
S2 |
Sulfur diatomic |
1 |
Σg |
690 |
720 |
1.043 |
38 |
42 |
HF |
Hydrogen fluoride |
1 |
Σ |
3887 |
3961 |
1.019 |
39 |
43 |
LiF |
lithium fluoride |
1 |
Σ |
973 |
896 |
0.921 |
40 |
44 |
BeF |
Beryllium monofluoride |
1 |
Σ |
1246 |
|
|
41 |
45 |
CF |
Fluoromethylidyne |
1 |
Σ |
1327 |
1286 |
0.969 |
42 |
46 |
NF |
nitrogen fluoride |
1 |
Σ |
1201 |
1123 |
0.936 |
43 |
47 |
F2 |
Fluorine diatomic |
1 |
Σg |
1001 |
894 |
0.893 |
44 |
48 |
NaF |
sodium fluoride |
1 |
Σ |
576 |
529 |
0.918 |
45 |
49 |
MgF |
Magnesium monofluoride |
1 |
Σ |
718 |
|
|
46 |
50 |
AlF |
Aluminum monofluoride |
1 |
Σ |
797 |
793 |
0.994 |
47 |
51 |
SiF |
silicon monofluoride |
1 |
Σ |
840 |
848 |
1.010 |
48 |
52 |
PF |
phosphorus monofluoride |
1 |
Σ |
825 |
838 |
1.016 |
49 |
53 |
SF |
Monosulfur monofluoride |
1 |
Σ |
804 |
829 |
1.031 |
50 |
54 |
HCl |
Hydrogen chloride |
1 |
Σ |
2805 |
2886 |
1.029 |
51 |
55 |
LiCl |
lithium chloride |
1 |
Σ |
649 |
634 |
0.976 |
52 |
56 |
BeCl |
beryllium monochloride |
1 |
Σ |
845 |
847 |
1.002 |
53 |
57 |
BCl |
boron monochloride |
1 |
Σ |
837 |
829 |
0.991 |
54 |
58 |
CCl |
carbon monochloride |
1 |
Σ |
876 |
866 |
0.989 |
55 |
59 |
ClO |
Monochlorine monoxide |
1 |
Σ |
852 |
843 |
0.989 |
56 |
60 |
ClF |
Chlorine monofluoride |
1 |
Σ |
754 |
773 |
1.026 |
57 |
61 |
NaCl |
Sodium Chloride |
1 |
Σ |
368 |
361 |
0.981 |
58 |
62 |
MgCl |
magnesium monochloride |
1 |
Σ |
447 |
|
|
59 |
63 |
AlCl |
Aluminum monochloride |
1 |
Σ |
466 |
478 |
1.024 |
60 |
64 |
SiCl |
Clorosilylidyne |
1 |
Σ |
516 |
531 |
1.029 |
61 |
65 |
PCl |
phosphorus chloride |
1 |
Σ |
534 |
547 |
1.024 |
62 |
66 |
SCl |
sulfur monochloride |
1 |
Σ |
554 |
577 |
1.041 |
63 |
67 |
Cl2 |
Chlorine diatomic |
1 |
Σg |
526 |
554 |
1.054 |
64 |
68 |
BeH2 |
beryllium dihydride |
2 |
Σu |
2207 |
2159 |
0.978 |
65 |
69 |
|
|
3 |
Πu |
720 |
698 |
0.970 |
65 |
70 |
MgH2 |
magnesium dihydride |
2 |
Σu |
1616 |
1572 |
0.973 |
66 |
71 |
|
|
3 |
Πu |
449 |
440 |
0.979 |
66 |
72 |
BH2 |
boron dihydride |
2 |
A1 |
925 |
954 |
1.031 |
67 |
73 |
AlH2 |
aluminum dihydride |
1 |
A1 |
1771 |
1770 |
1.000 |
68 |
74 |
|
|
2 |
A1 |
734 |
760 |
1.036 |
68 |
75 |
|
|
3 |
B2 |
1822 |
1807 |
0.992 |
68 |
76 |
SiH2 |
silicon dihydride |
1 |
A1 |
1978 |
1996 |
1.009 |
69 |
77 |
|
|
2 |
A1 |
981 |
999 |
1.019 |
69 |
78 |
|
|
3 |
B2 |
1985 |
1993 |
1.004 |
69 |
79 |
NH2 |
Amino radical |
1 |
A1 |
3239 |
3219 |
0.994 |
70 |
80 |
|
|
2 |
A1 |
1518 |
1497 |
0.986 |
70 |
81 |
|
|
3 |
B2 |
3347 |
3301 |
0.986 |
70 |
82 |
HCN |
Hydrogen cyanide |
1 |
Σ |
3361 |
3312 |
0.985 |
71 |
83 |
|
|
2 |
Σ |
2161 |
2089 |
0.967 |
71 |
84 |
|
|
3 |
Π |
737 |
712 |
0.965 |
71 |
85 |
HNC |
hydrogen isocyanide |
1 |
Σ |
3704 |
3653 |
0.986 |
72 |
86 |
|
|
2 |
Σ |
2076 |
2029 |
0.977 |
72 |
87 |
|
|
3 |
Π |
473 |
477 |
1.009 |
72 |
88 |
PH2 |
Phosphino radical |
1 |
A1 |
2283 |
2310 |
1.012 |
73 |
89 |
|
|
2 |
A1 |
1096 |
1102 |
1.006 |
73 |
90 |
HCP |
Phosphaethyne |
1 |
Σ |
3268 |
3217 |
0.984 |
74 |
91 |
|
|
2 |
Σ |
1329 |
1278 |
0.962 |
74 |
92 |
|
|
3 |
Π |
680 |
674 |
0.992 |
74 |
93 |
HPO |
Hydrogen phosphorus oxide |
1 |
A' |
1985 |
2095 |
1.055 |
75 |
94 |
|
|
2 |
A' |
1198 |
1188 |
0.992 |
75 |
95 |
|
|
3 |
A' |
980 |
986 |
1.005 |
75 |
96 |
H2O |
Water |
1 |
A1 |
3690 |
3657 |
0.991 |
76 |
97 |
|
|
2 |
A1 |
1627 |
1595 |
0.981 |
76 |
98 |
|
|
3 |
B2 |
3817 |
3756 |
0.984 |
76 |
99 |
LiOH |
lithium hydroxide |
1 |
Σ |
3885 |
3688 |
0.949 |
77 |
100 |
|
|
2 |
Σ |
1011 |
871 |
0.861 |
77 |
101 |
|
|
3 |
Π |
386 |
257 |
0.664 |
77 |
102 |
BeOH |
beryllium monohydroxide |
2 |
A' |
1325 |
1246 |
0.940 |
78 |
103 |
HBO |
Boron hydride oxide |
1 |
Σ |
2817 |
2850 |
1.012 |
79 |
104 |
|
|
2 |
Σ |
1847 |
1826 |
0.989 |
79 |
105 |
|
|
3 |
Π |
746 |
756 |
1.013 |
79 |
106 |
HCO |
Formyl radical |
1 |
A' |
2556 |
2434 |
0.953 |
80 |
107 |
|
|
2 |
A' |
1935 |
1868 |
0.965 |
80 |
108 |
|
|
3 |
A' |
1085 |
1081 |
0.996 |
80 |
109 |
HNO |
Nitrosyl hydride |
1 |
A' |
2620 |
2684 |
1.025 |
81 |
110 |
|
|
2 |
A' |
1670 |
1565 |
0.937 |
81 |
111 |
|
|
3 |
A' |
1548 |
1501 |
0.969 |
81 |
112 |
HO2 |
Hydroperoxy radical |
1 |
A' |
3337 |
3436 |
1.030 |
82 |
113 |
|
|
2 |
A' |
1437 |
1392 |
0.969 |
82 |
114 |
|
|
3 |
A' |
1189 |
1098 |
0.923 |
82 |
115 |
N2O |
Nitrous oxide |
1 |
Σ |
2380 |
2224 |
0.934 |
83 |
116 |
|
|
2 |
Σ |
1363 |
1285 |
0.943 |
83 |
117 |
|
|
3 |
Π |
614 |
589 |
0.960 |
83 |
118 |
SiO2 |
silicon dioxide |
2 |
Σu |
1454 |
1416 |
0.974 |
84 |
119 |
|
|
3 |
Πu |
289 |
273 |
0.942 |
84 |
120 |
H2S |
Hydrogen sulfide |
1 |
A1 |
2584 |
2615 |
1.012 |
85 |
121 |
|
|
2 |
A1 |
1189 |
1183 |
0.995 |
85 |
122 |
|
|
3 |
B2 |
2606 |
2626 |
1.008 |
85 |
123 |
HBS |
hydrogen boron sulfide |
1 |
Σ |
2755 |
2736 |
0.993 |
86 |
124 |
|
|
2 |
Σ |
1186 |
1172 |
0.989 |
86 |
125 |
OCS |
Carbonyl sulfide |
1 |
Σ |
2137 |
2062 |
0.965 |
87 |
126 |
|
|
2 |
Σ |
890 |
859 |
0.966 |
87 |
127 |
|
|
3 |
Π |
509 |
520 |
1.022 |
87 |
128 |
SO2 |
Sulfur dioxide |
1 |
A1 |
1121 |
1151 |
1.027 |
88 |
129 |
|
|
2 |
A1 |
490 |
518 |
1.056 |
88 |
130 |
|
|
3 |
B2 |
1308 |
1362 |
1.041 |
88 |
131 |
SSO |
Disulfur monoxide |
1 |
A' |
1139 |
1166 |
1.024 |
89 |
132 |
|
|
2 |
A' |
656 |
679 |
1.035 |
89 |
133 |
|
|
3 |
A' |
367 |
380 |
1.036 |
89 |
134 |
HOF |
Hypofluorous acid |
1 |
A' |
3582 |
3578 |
0.999 |
90 |
135 |
|
|
2 |
A' |
1388 |
1362 |
0.981 |
90 |
136 |
|
|
3 |
A' |
976 |
893 |
0.915 |
90 |
137 |
CF2 |
Difluoromethylene |
1 |
A1 |
1236 |
1225 |
0.991 |
91 |
138 |
|
|
2 |
A1 |
671 |
667 |
0.994 |
91 |
139 |
|
|
3 |
B2 |
1135 |
1114 |
0.982 |
91 |
140 |
FNO |
Nitrosyl fluoride |
1 |
A' |
1928 |
1844 |
0.957 |
92 |
141 |
|
|
2 |
A' |
817 |
766 |
0.937 |
92 |
142 |
|
|
3 |
A' |
539 |
520 |
0.965 |
92 |
143 |
NF2 |
Difluoroamino radical |
1 |
A1 |
1111 |
1075 |
0.967 |
93 |
144 |
|
|
2 |
A1 |
577 |
573 |
0.994 |
93 |
145 |
|
|
3 |
B2 |
950 |
942 |
0.992 |
93 |
146 |
F2O |
Difluorine monoxide |
1 |
A1 |
1002 |
928 |
0.927 |
94 |
147 |
|
|
2 |
A1 |
469 |
461 |
0.982 |
94 |
148 |
|
|
3 |
B2 |
820 |
831 |
1.013 |
94 |
149 |
HOCl |
hypochlorous acid |
1 |
A' |
3621 |
3609 |
0.997 |
95 |
150 |
|
|
2 |
A' |
1254 |
1239 |
0.988 |
95 |
151 |
|
|
3 |
A' |
719 |
724 |
1.008 |
95 |
152 |
ClCN |
chlorocyanogen |
1 |
Σ |
2277 |
2216 |
0.973 |
96 |
153 |
|
|
2 |
Σ |
762 |
744 |
0.977 |
96 |
154 |
|
|
3 |
Π |
397 |
378 |
0.952 |
96 |
155 |
ClNO |
Nitrosyl chloride |
1 |
A' |
1927 |
1800 |
0.934 |
97 |
156 |
|
|
2 |
A' |
612 |
596 |
0.974 |
97 |
157 |
|
|
3 |
A' |
335 |
332 |
0.991 |
97 |
158 |
OClO |
Chlorine dioxide |
1 |
A1 |
896 |
946 |
1.055 |
98 |
159 |
|
|
2 |
A1 |
405 |
448 |
1.104 |
98 |
160 |
|
|
3 |
B2 |
1024 |
1110 |
1.084 |
98 |
161 |
CCl2 |
dichloromethylene |
1 |
A1 |
719 |
730 |
1.016 |
99 |
162 |
|
|
2 |
A1 |
329 |
335 |
1.018 |
99 |
163 |
|
|
3 |
B2 |
734 |
758 |
1.032 |
99 |
164 |
Cl2O |
Dichlorine monoxide |
1 |
A1 |
638 |
639 |
1.002 |
100 |
165 |
|
|
2 |
A1 |
286 |
296 |
1.037 |
100 |
166 |
|
|
3 |
B2 |
577 |
686 |
1.190 |
100 |
167 |
SiCl2 |
Dichlorosilylene |
1 |
A1 |
503 |
522 |
1.037 |
101 |
168 |
|
|
2 |
A1 |
195 |
201 |
1.031 |
101 |
169 |
|
|
3 |
B2 |
495 |
509 |
1.029 |
101 |
170 |
ClS2 |
Sulfur chloride |
1 |
A' |
659 |
662 |
1.005 |
102 |
171 |
|
|
2 |
A' |
393 |
450 |
1.144 |
102 |
172 |
|
|
3 |
A' |
199 |
196 |
0.983 |
102 |
173 |
BH3 |
boron trihydride |
2 |
A2" |
1092 |
1148 |
1.051 |
103 |
174 |
|
|
3 |
E' |
2631 |
2602 |
0.989 |
103 |
175 |
|
|
4 |
E' |
1125 |
1197 |
1.064 |
103 |
176 |
AlH3 |
aluminum trihydride |
1 |
A1' |
1888 |
1900 |
1.006 |
104 |
177 |
|
|
2 |
A2" |
675 |
698 |
1.034 |
104 |
178 |
|
|
3 |
E' |
1908 |
1883 |
0.987 |
104 |
179 |
|
|
4 |
E' |
752 |
783 |
1.042 |
104 |
180 |
SiH3 |
Silyl radical |
1 |
A1 |
2138 |
2136 |
0.999 |
105 |
181 |
|
|
2 |
A1 |
691 |
728 |
1.054 |
105 |
182 |
|
|
3 |
E |
2186 |
2185 |
1.000 |
105 |
183 |
|
|
4 |
E |
888 |
922 |
1.038 |
105 |
184 |
NH3 |
Ammonia |
1 |
A1 |
3407 |
3337 |
0.979 |
106 |
185 |
|
|
2 |
A1 |
1031 |
950 |
0.922 |
106 |
186 |
|
|
3 |
E |
3548 |
3444 |
0.971 |
106 |
187 |
|
|
4 |
E |
1678 |
1627 |
0.970 |
106 |
188 |
C2N2 |
Cyanogen |
1 |
Σg |
2396 |
2330 |
0.972 |
107 |
189 |
|
|
2 |
Σg |
899 |
846 |
0.941 |
107 |
190 |
|
|
3 |
Σu |
2217 |
2158 |
0.973 |
107 |
191 |
|
|
4 |
Πg |
572 |
503 |
0.879 |
107 |
192 |
|
|
5 |
Πu |
254 |
234 |
0.920 |
107 |
193 |
PH3 |
Phosphine |
1 |
A1 |
2311 |
2323 |
1.005 |
108 |
194 |
|
|
2 |
A1 |
991 |
992 |
1.001 |
108 |
195 |
|
|
3 |
E |
2330 |
2328 |
0.999 |
108 |
196 |
|
|
4 |
E |
1116 |
1118 |
1.002 |
108 |
197 |
P4 |
Phosphorus tetramer |
1 |
A1 |
613 |
601 |
0.980 |
109 |
198 |
|
|
2 |
E |
378 |
361 |
0.955 |
109 |
199 |
|
|
3 |
T2 |
471 |
467 |
0.991 |
109 |
200 |
H2O2 |
Hydrogen peroxide |
1 |
A |
3628 |
3599 |
0.992 |
110 |
201 |
|
|
2 |
A |
1457 |
1402 |
0.962 |
110 |
202 |
|
|
3 |
A |
963 |
877 |
0.910 |
110 |
203 |
|
|
4 |
A |
356 |
371 |
1.041 |
110 |
204 |
|
|
5 |
B |
3630 |
3608 |
0.994 |
110 |
205 |
|
|
6 |
B |
1291 |
1266 |
0.980 |
110 |
206 |
HNO2 |
Nitrous acid |
1 |
A' |
3624 |
3591 |
0.991 |
111 |
207 |
|
|
2 |
A' |
1792 |
1700 |
0.948 |
111 |
208 |
|
|
3 |
A' |
1261 |
1263 |
1.001 |
111 |
209 |
|
|
4 |
A' |
837 |
790 |
0.944 |
111 |
210 |
|
|
5 |
A' |
605 |
596 |
0.984 |
111 |
211 |
|
|
6 |
A" |
630 |
543 |
0.862 |
111 |
212 |
B2O2 |
Diboron dioxide |
1 |
Σg |
2113 |
2060 |
0.975 |
112 |
213 |
|
|
2 |
Σg |
621 |
585 |
0.941 |
112 |
214 |
|
|
3 |
Σu |
1941 |
1898 |
0.978 |
112 |
215 |
|
|
4 |
Πg |
498 |
410 |
0.823 |
112 |
216 |
|
|
5 |
Πu |
212 |
213 |
1.006 |
112 |
217 |
H2CS |
Thioformaldehyde |
1 |
A1 |
2981 |
2971 |
0.997 |
113 |
218 |
|
|
2 |
A1 |
1448 |
1456 |
1.005 |
113 |
219 |
|
|
3 |
A1 |
1092 |
1059 |
0.970 |
113 |
220 |
|
|
4 |
B1 |
984 |
990 |
1.006 |
113 |
221 |
|
|
5 |
B2 |
3069 |
3025 |
0.986 |
113 |
222 |
|
|
6 |
B2 |
991 |
991 |
1.000 |
113 |
223 |
H2S2 |
Disulfane |
1 |
A |
2511 |
2556 |
1.018 |
114 |
224 |
|
|
2 |
A |
871 |
882 |
1.012 |
114 |
225 |
|
|
3 |
A |
495 |
515 |
1.039 |
114 |
226 |
|
|
4 |
A |
452 |
417 |
0.923 |
114 |
227 |
|
|
5 |
B |
2513 |
2559 |
1.018 |
114 |
228 |
|
|
6 |
B |
868 |
878 |
1.011 |
114 |
229 |
SO3 |
Sulfur trioxide |
1 |
A1' |
1020 |
1065 |
1.044 |
115 |
230 |
|
|
2 |
A2" |
455 |
498 |
1.094 |
115 |
231 |
|
|
3 |
E' |
1352 |
1391 |
1.029 |
115 |
232 |
|
|
4 |
E' |
484 |
530 |
1.094 |
115 |
233 |
BHF2 |
Difluoroborane |
1 |
A1 |
2623 |
2621 |
0.999 |
116 |
234 |
|
|
2 |
A1 |
1161 |
1164 |
1.003 |
116 |
235 |
|
|
3 |
A1 |
531 |
542 |
1.021 |
116 |
236 |
|
|
4 |
B1 |
883 |
924 |
1.046 |
116 |
237 |
|
|
5 |
B2 |
1431 |
1402 |
0.980 |
116 |
238 |
BF3 |
Borane, trifluoro- |
1 |
A1' |
882 |
888 |
1.007 |
117 |
239 |
|
|
2 |
A2" |
667 |
691 |
1.036 |
117 |
240 |
|
|
3 |
E' |
1467 |
1449 |
0.988 |
117 |
241 |
|
|
4 |
E' |
465 |
480 |
1.032 |
117 |
242 |
N2F2 |
Dinitrogen difluoride, (E)- |
1 |
Ag |
1559 |
1523 |
0.977 |
118 |
243 |
|
|
2 |
Ag |
1071 |
1018 |
0.950 |
118 |
244 |
|
|
3 |
Ag |
623 |
603 |
0.968 |
118 |
245 |
|
|
4 |
Au |
367 |
364 |
0.993 |
118 |
246 |
|
|
5 |
Bu |
1042 |
991 |
0.951 |
118 |
247 |
|
|
6 |
Bu |
424 |
423 |
0.998 |
118 |
248 |
CF3 |
Trifluoromethyl radical |
1 |
A1 |
1084 |
1089 |
1.004 |
119 |
249 |
|
|
2 |
A1 |
694 |
701 |
1.011 |
119 |
250 |
|
|
3 |
E |
1262 |
1260 |
0.998 |
119 |
251 |
|
|
4 |
E |
504 |
509 |
1.010 |
119 |
252 |
NF3 |
Nitrogen trifluoride |
1 |
A1 |
1049 |
1032 |
0.984 |
120 |
253 |
|
|
2 |
A1 |
648 |
647 |
0.998 |
120 |
254 |
|
|
3 |
E |
872 |
907 |
1.040 |
120 |
255 |
|
|
4 |
E |
482 |
492 |
1.020 |
120 |
256 |
AlF3 |
Aluminum trifluoride |
1 |
A1' |
688 |
690 |
1.002 |
121 |
257 |
|
|
2 |
A2" |
277 |
297 |
1.071 |
121 |
258 |
|
|
3 |
E' |
974 |
935 |
0.960 |
121 |
259 |
|
|
4 |
E' |
232 |
263 |
1.133 |
121 |
260 |
PF3 |
Phosphorus trifluoride |
1 |
A1 |
867 |
892 |
1.029 |
122 |
261 |
|
|
2 |
A1 |
447 |
487 |
1.089 |
122 |
262 |
|
|
3 |
E |
841 |
860 |
1.022 |
122 |
263 |
|
|
4 |
E |
315 |
344 |
1.093 |
122 |
264 |
BHCl2 |
Borane, dichloro- |
1 |
A1 |
2627 |
2617 |
0.996 |
123 |
265 |
|
|
2 |
A1 |
743 |
740 |
0.996 |
123 |
266 |
|
|
4 |
B1 |
740 |
784 |
1.060 |
123 |
267 |
|
|
5 |
B2 |
1062 |
1089 |
1.026 |
123 |
268 |
|
|
6 |
B2 |
903 |
892 |
0.987 |
123 |
269 |
ClNO2 |
Nitryl chloride |
1 |
A1 |
1379 |
1267 |
0.919 |
124 |
270 |
|
|
2 |
A1 |
806 |
793 |
0.984 |
124 |
271 |
|
|
3 |
A1 |
371 |
364 |
0.980 |
124 |
272 |
|
|
4 |
B1 |
669 |
652 |
0.975 |
124 |
273 |
|
|
5 |
B2 |
1875 |
1684 |
0.898 |
124 |
274 |
|
|
6 |
B2 |
406 |
408 |
1.005 |
124 |
275 |
ClF3 |
Chlorine trifluoride |
1 |
A1 |
677 |
752 |
1.111 |
125 |
276 |
|
|
2 |
A1 |
514 |
529 |
1.029 |
125 |
277 |
|
|
3 |
A1 |
260 |
328 |
1.262 |
125 |
278 |
|
|
4 |
B1 |
309 |
328 |
1.062 |
125 |
279 |
|
|
5 |
B2 |
729 |
702 |
0.964 |
125 |
280 |
|
|
6 |
B2 |
359 |
442 |
1.231 |
125 |
281 |
C2Cl2 |
dichloroacetylene |
4 |
Πg |
255 |
333 |
1.304 |
126 |
282 |
|
|
5 |
Πu |
172 |
172 |
0.998 |
126 |
283 |
AlF2Cl |
Aluminum chloride difluoride |
1 |
A1 |
833 |
820 |
0.984 |
127 |
284 |
|
|
2 |
A1 |
509 |
500 |
0.983 |
127 |
285 |
|
|
3 |
A1 |
219 |
250 |
1.142 |
127 |
286 |
|
|
4 |
B1 |
245 |
260 |
1.062 |
127 |
287 |
|
|
5 |
B2 |
964 |
900 |
0.933 |
127 |
288 |
|
|
6 |
B2 |
171 |
200 |
1.167 |
127 |
289 |
BCl3 |
Borane, trichloro- |
1 |
A1' |
478 |
471 |
0.986 |
128 |
290 |
|
|
2 |
A2" |
441 |
460 |
1.042 |
128 |
291 |
|
|
3 |
E' |
967 |
956 |
0.988 |
128 |
292 |
|
|
4 |
E' |
256 |
243 |
0.947 |
128 |
293 |
AlFCl2 |
Aluminum dichloride fluoride |
1 |
A1 |
895 |
850 |
0.949 |
129 |
294 |
|
|
2 |
A1 |
438 |
450 |
1.027 |
129 |
295 |
|
|
3 |
A1 |
143 |
150 |
1.048 |
129 |
296 |
|
|
4 |
B1 |
218 |
220 |
1.009 |
129 |
297 |
|
|
5 |
B2 |
640 |
610 |
0.952 |
129 |
298 |
|
|
6 |
B2 |
187 |
200 |
1.071 |
129 |
299 |
AlCl3 |
Aluminum trichloride |
1 |
A1' |
386 |
375 |
0.971 |
130 |
300 |
|
|
2 |
A2" |
189 |
183 |
0.968 |
130 |
301 |
|
|
3 |
E' |
631 |
595 |
0.943 |
130 |
302 |
|
|
4 |
E' |
138 |
150 |
1.084 |
130 |
303 |
PCl3 |
Phosphorus trichloride |
1 |
A1 |
489 |
504 |
1.031 |
131 |
304 |
|
|
2 |
A1 |
247 |
252 |
1.021 |
131 |
305 |
|
|
3 |
E |
466 |
482 |
1.033 |
131 |
306 |
|
|
4 |
E |
178 |
198 |
1.110 |
131 |
307 |
ClSSCl |
Disulfur dichloride |
1 |
A |
572 |
546 |
0.955 |
132 |
308 |
|
|
2 |
A |
410 |
466 |
1.137 |
132 |
309 |
|
|
3 |
A |
203 |
202 |
0.993 |
132 |
310 |
|
|
4 |
A |
93 |
95 |
1.024 |
132 |
311 |
|
|
5 |
B |
393 |
461 |
1.173 |
132 |
312 |
|
|
6 |
B |
226 |
244 |
1.082 |
132 |
313 |
SiH4 |
Silane |
1 |
A1 |
2173 |
2187 |
1.007 |
133 |
314 |
|
|
2 |
E |
936 |
975 |
1.042 |
133 |
315 |
|
|
3 |
T2 |
2192 |
2191 |
1.000 |
133 |
316 |
|
|
4 |
T2 |
849 |
914 |
1.077 |
133 |
317 |
CH2NH |
Methanimine |
1 |
A' |
3340 |
3263 |
0.977 |
134 |
318 |
|
|
2 |
A' |
3026 |
3024 |
1.000 |
134 |
319 |
|
|
3 |
A' |
2917 |
2914 |
0.999 |
134 |
320 |
|
|
4 |
A' |
1709 |
1638 |
0.959 |
134 |
321 |
|
|
5 |
A' |
1456 |
1452 |
0.997 |
134 |
322 |
|
|
6 |
A' |
1330 |
1344 |
1.011 |
134 |
323 |
|
|
7 |
A' |
1054 |
1058 |
1.004 |
134 |
324 |
|
|
8 |
A" |
1146 |
1127 |
0.984 |
134 |
325 |
|
|
9 |
A" |
1050 |
1061 |
1.010 |
134 |
326 |
NH2OH |
hydroxylamine |
1 |
A' |
3681 |
3650 |
0.992 |
135 |
327 |
|
|
2 |
A' |
3350 |
3294 |
0.983 |
135 |
328 |
|
|
3 |
A' |
1676 |
1605 |
0.957 |
135 |
329 |
|
|
4 |
A' |
1403 |
1353 |
0.965 |
135 |
330 |
|
|
5 |
A' |
1136 |
1115 |
0.982 |
135 |
331 |
|
|
6 |
A' |
949 |
895 |
0.943 |
135 |
332 |
|
|
7 |
A" |
3433 |
3359 |
0.978 |
135 |
333 |
|
|
8 |
A" |
1324 |
1295 |
0.978 |
135 |
334 |
|
|
9 |
A" |
454 |
386 |
0.850 |
135 |
335 |
CH2CO |
Ketene |
1 |
A1 |
3111 |
3070 |
0.987 |
136 |
336 |
|
|
2 |
A1 |
2250 |
2152 |
0.956 |
136 |
337 |
|
|
3 |
A1 |
1357 |
1388 |
1.023 |
136 |
338 |
|
|
4 |
A1 |
1156 |
1118 |
0.967 |
136 |
339 |
|
|
5 |
B1 |
571 |
588 |
1.029 |
136 |
340 |
|
|
6 |
B1 |
525 |
528 |
1.006 |
136 |
341 |
|
|
7 |
B2 |
3200 |
3166 |
0.989 |
136 |
342 |
|
|
8 |
B2 |
950 |
977 |
1.028 |
136 |
343 |
|
|
9 |
B2 |
434 |
433 |
0.999 |
136 |
344 |
HCOOH |
Formic acid |
1 |
A' |
3562 |
3570 |
1.002 |
137 |
345 |
|
|
2 |
A' |
2964 |
2943 |
0.993 |
137 |
346 |
|
|
3 |
A' |
1838 |
1770 |
0.963 |
137 |
347 |
|
|
4 |
A' |
1354 |
1387 |
1.025 |
137 |
348 |
|
|
5 |
A' |
1285 |
1229 |
0.956 |
137 |
349 |
|
|
6 |
A' |
1136 |
1105 |
0.973 |
137 |
350 |
|
|
7 |
A' |
617 |
625 |
1.014 |
137 |
351 |
|
|
8 |
A" |
1010 |
1033 |
1.023 |
137 |
352 |
|
|
9 |
A" |
741 |
638 |
0.861 |
137 |
353 |
HNO3 |
Nitric acid |
1 |
A' |
3586 |
3550 |
0.990 |
138 |
354 |
|
|
2 |
A' |
1815 |
1708 |
0.941 |
138 |
355 |
|
|
3 |
A' |
1368 |
1331 |
0.973 |
138 |
356 |
|
|
4 |
A' |
1295 |
1325 |
1.023 |
138 |
357 |
|
|
5 |
A' |
904 |
879 |
0.972 |
138 |
358 |
|
|
6 |
A' |
657 |
647 |
0.984 |
138 |
359 |
|
|
7 |
A' |
585 |
579 |
0.990 |
138 |
360 |
|
|
8 |
A" |
785 |
762 |
0.971 |
138 |
361 |
|
|
9 |
A" |
521 |
456 |
0.875 |
138 |
362 |
C3O2 |
Carbon suboxide |
1 |
Σg |
2267 |
2196 |
0.969 |
139 |
363 |
|
|
2 |
Σg |
777 |
786 |
1.011 |
139 |
364 |
|
|
3 |
Σu |
2438 |
2258 |
0.926 |
139 |
365 |
|
|
4 |
Σu |
1636 |
1573 |
0.961 |
139 |
366 |
|
|
5 |
Πg |
576 |
573 |
0.994 |
139 |
367 |
|
|
6 |
Πu |
588 |
550 |
0.936 |
139 |
368 |
|
|
7 |
Πu |
96 |
61 |
0.635 |
139 |
369 |
CH3F |
Methyl fluoride |
1 |
A1 |
2944 |
2930 |
0.995 |
140 |
370 |
|
|
2 |
A1 |
1452 |
1464 |
1.009 |
140 |
371 |
|
|
3 |
A1 |
1102 |
1049 |
0.952 |
140 |
372 |
|
|
4 |
E |
3029 |
3006 |
0.993 |
140 |
373 |
|
|
5 |
E |
1439 |
1467 |
1.019 |
140 |
374 |
|
|
6 |
E |
1163 |
1182 |
1.016 |
140 |
375 |
FNO3 |
Fluorine nitrate |
1 |
A' |
1903 |
1759 |
0.925 |
141 |
376 |
|
|
2 |
A' |
1378 |
1301 |
0.944 |
141 |
377 |
|
|
3 |
A' |
974 |
928 |
0.953 |
141 |
378 |
|
|
4 |
A' |
806 |
804 |
0.998 |
141 |
379 |
|
|
5 |
A' |
656 |
633 |
0.965 |
141 |
380 |
|
|
6 |
A' |
452 |
455 |
1.006 |
141 |
381 |
|
|
7 |
A' |
291 |
303 |
1.040 |
141 |
382 |
|
|
8 |
A" |
716 |
709 |
0.991 |
141 |
383 |
|
|
9 |
A" |
190 |
152 |
0.802 |
141 |
384 |
SiH3F |
monofluorosilane |
1 |
A1 |
2186 |
2206 |
1.009 |
142 |
385 |
|
|
2 |
A1 |
979 |
990 |
1.011 |
142 |
386 |
|
|
3 |
A1 |
860 |
872 |
1.013 |
142 |
387 |
|
|
4 |
E |
2199 |
2196 |
0.999 |
142 |
388 |
|
|
5 |
E |
901 |
956 |
1.061 |
142 |
389 |
|
|
6 |
E |
701 |
728 |
1.039 |
142 |
390 |
SiF4 |
Silicon tetrafluoride |
1 |
A1 |
774 |
800 |
1.034 |
143 |
391 |
|
|
2 |
E |
245 |
268 |
1.092 |
143 |
392 |
|
|
3 |
T2 |
1030 |
1032 |
1.002 |
143 |
393 |
|
|
4 |
T2 |
360 |
389 |
1.079 |
143 |
394 |
F3PO |
Phosphoryl fluoride |
1 |
A1 |
1409 |
1417 |
1.006 |
144 |
395 |
|
|
2 |
A1 |
831 |
873 |
1.050 |
144 |
396 |
|
|
3 |
A1 |
446 |
472 |
1.059 |
144 |
397 |
|
|
4 |
E |
962 |
991 |
1.030 |
144 |
398 |
|
|
5 |
E |
431 |
482 |
1.117 |
144 |
399 |
|
|
6 |
E |
306 |
336 |
1.096 |
144 |
400 |
SiH3Cl |
chlorosilane |
1 |
A1 |
2189 |
2201 |
1.006 |
145 |
401 |
|
|
2 |
A1 |
903 |
949 |
1.051 |
145 |
402 |
|
|
3 |
A1 |
541 |
551 |
1.018 |
145 |
403 |
|
|
4 |
E |
2209 |
2195 |
0.994 |
145 |
404 |
|
|
5 |
E |
902 |
954 |
1.057 |
145 |
405 |
|
|
6 |
E |
636 |
664 |
1.044 |
145 |
406 |
SiH2Cl2 |
dichlorosilane |
1 |
A1 |
2211 |
2224 |
1.006 |
146 |
407 |
|
|
2 |
A1 |
908 |
954 |
1.051 |
146 |
408 |
|
|
3 |
A1 |
520 |
527 |
1.014 |
146 |
409 |
|
|
4 |
A1 |
185 |
188 |
1.015 |
146 |
410 |
|
|
5 |
A2 |
689 |
710 |
1.031 |
146 |
411 |
|
|
6 |
B1 |
2230 |
2237 |
1.003 |
146 |
412 |
|
|
7 |
B1 |
572 |
602 |
1.052 |
146 |
413 |
|
|
8 |
B2 |
841 |
876 |
1.041 |
146 |
414 |
|
|
9 |
B2 |
581 |
590 |
1.016 |
146 |
415 |
ClFO3 |
Perchloryl fluoride |
1 |
A1 |
986 |
1061 |
1.076 |
147 |
416 |
|
|
2 |
A1 |
673 |
715 |
1.062 |
147 |
417 |
|
|
3 |
A1 |
480 |
549 |
1.144 |
147 |
418 |
|
|
4 |
E |
1235 |
1315 |
1.065 |
147 |
419 |
|
|
5 |
E |
517 |
589 |
1.138 |
147 |
420 |
|
|
6 |
E |
341 |
405 |
1.187 |
147 |
421 |
SO2Cl2 |
Sulfuryl chloride |
1 |
A1 |
1161 |
1205 |
1.038 |
148 |
422 |
|
|
2 |
A1 |
521 |
577 |
1.108 |
148 |
423 |
|
|
3 |
A1 |
365 |
408 |
1.119 |
148 |
424 |
|
|
4 |
A1 |
190 |
218 |
1.145 |
148 |
425 |
|
|
5 |
A2 |
253 |
282 |
1.115 |
148 |
426 |
|
|
6 |
B1 |
541 |
586 |
1.083 |
148 |
427 |
|
|
7 |
B1 |
347 |
388 |
1.118 |
148 |
428 |
|
|
8 |
B2 |
1413 |
1434 |
1.015 |
148 |
429 |
|
|
9 |
B2 |
333 |
362 |
1.088 |
148 |
430 |
SiHCl3 |
Trichlorosilane |
1 |
A1 |
2252 |
2261 |
1.004 |
149 |
431 |
|
|
2 |
A1 |
488 |
499 |
1.023 |
149 |
432 |
|
|
3 |
A1 |
247 |
254 |
1.029 |
149 |
433 |
|
|
4 |
E |
773 |
811 |
1.049 |
149 |
434 |
|
|
5 |
E |
593 |
600 |
1.011 |
149 |
435 |
|
|
6 |
E |
174 |
176 |
1.012 |
149 |
436 |
Cl3PO |
Phosphoryl chloride |
1 |
A1 |
1310 |
1322 |
1.009 |
150 |
437 |
|
|
2 |
A1 |
456 |
481 |
1.054 |
150 |
438 |
|
|
3 |
A1 |
260 |
266 |
1.023 |
150 |
439 |
|
|
4 |
E |
563 |
590 |
1.048 |
150 |
440 |
|
|
5 |
E |
316 |
333 |
1.055 |
150 |
441 |
|
|
6 |
E |
183 |
187 |
1.022 |
150 |
442 |
SiCl4 |
Silane, tetrachloro- |
1 |
A1 |
416 |
424 |
1.019 |
151 |
443 |
|
|
2 |
E |
147 |
150 |
1.018 |
151 |
444 |
|
|
3 |
T2 |
617 |
621 |
1.007 |
151 |
445 |
|
|
4 |
T2 |
219 |
221 |
1.010 |
151 |
446 |
C3H3 |
Propargyl radical |
1 |
A1 |
3382 |
3322 |
0.982 |
152 |
447 |
|
|
6 |
B1 |
668 |
687 |
1.029 |
152 |
448 |
|
|
7 |
B1 |
401 |
490 |
1.221 |
152 |
449 |
C4H2 |
Diacetylene |
6 |
Πg |
570 |
627 |
1.100 |
153 |
450 |
|
|
7 |
Πg |
497 |
482 |
0.970 |
153 |
451 |
|
|
8 |
Πu |
553 |
630 |
1.140 |
153 |
452 |
|
|
9 |
Πu |
228 |
231 |
1.013 |
153 |
453 |
N2H4 |
Hydrazine |
1 |
A |
3485 |
3398 |
0.975 |
154 |
454 |
|
|
2 |
A |
3367 |
3329 |
0.989 |
154 |
455 |
|
|
3 |
A |
1686 |
1642 |
0.974 |
154 |
456 |
|
|
4 |
A |
1318 |
1275 |
0.967 |
154 |
457 |
|
|
5 |
A |
1167 |
1076 |
0.922 |
154 |
458 |
|
|
6 |
A |
749 |
780 |
1.042 |
154 |
459 |
|
|
7 |
A |
525 |
377 |
0.718 |
154 |
460 |
|
|
8 |
B |
3492 |
3350 |
0.959 |
154 |
461 |
|
|
9 |
B |
3362 |
3314 |
0.986 |
154 |
462 |
|
|
10 |
B |
1672 |
1628 |
0.974 |
154 |
463 |
|
|
11 |
B |
1281 |
1275 |
0.995 |
154 |
464 |
|
|
12 |
B |
913 |
966 |
1.058 |
154 |
465 |
CH3CN |
Acetonitrile |
1 |
A1 |
2984 |
2954 |
0.990 |
155 |
466 |
|
|
2 |
A1 |
2338 |
2267 |
0.970 |
155 |
467 |
|
|
3 |
A1 |
1357 |
1385 |
1.021 |
155 |
468 |
|
|
4 |
A1 |
962 |
920 |
0.956 |
155 |
469 |
|
|
5 |
E |
3063 |
3009 |
0.982 |
155 |
470 |
|
|
6 |
E |
1417 |
1448 |
1.022 |
155 |
471 |
|
|
7 |
E |
1016 |
1041 |
1.024 |
155 |
472 |
|
|
8 |
E |
389 |
362 |
0.931 |
155 |
473 |
C4N2 |
2-Butynedinitrile |
1 |
Σg |
2342 |
2290 |
0.978 |
156 |
474 |
|
|
2 |
Σg |
2163 |
2119 |
0.980 |
156 |
475 |
|
|
3 |
Σg |
627 |
692 |
1.103 |
156 |
476 |
|
|
4 |
Σu |
2305 |
2241 |
0.972 |
156 |
477 |
|
|
5 |
Σu |
1217 |
1154 |
0.948 |
156 |
478 |
|
|
6 |
Πg |
614 |
504 |
0.820 |
156 |
479 |
|
|
7 |
Πg |
293 |
263 |
0.898 |
156 |
480 |
|
|
8 |
Πu |
525 |
472 |
0.899 |
156 |
481 |
|
|
9 |
Πu |
113 |
107 |
0.951 |
156 |
482 |
CH3OH |
Methyl alcohol |
1 |
A' |
3703 |
3681 |
0.994 |
157 |
483 |
|
|
2 |
A' |
3047 |
3000 |
0.984 |
157 |
484 |
|
|
3 |
A' |
2895 |
2844 |
0.982 |
157 |
485 |
|
|
4 |
A' |
1463 |
1477 |
1.009 |
157 |
486 |
|
|
5 |
A' |
1439 |
1455 |
1.011 |
157 |
487 |
|
|
6 |
A' |
1340 |
1345 |
1.004 |
157 |
488 |
|
|
7 |
A' |
1108 |
1060 |
0.957 |
157 |
489 |
|
|
8 |
A' |
1047 |
1033 |
0.986 |
157 |
490 |
|
|
9 |
A" |
2940 |
2960 |
1.007 |
157 |
491 |
|
|
10 |
A" |
1441 |
1477 |
1.025 |
157 |
492 |
|
|
11 |
A" |
1138 |
1165 |
1.023 |
157 |
493 |
|
|
12 |
A" |
365 |
200 |
0.548 |
157 |
494 |
CHONH2 |
formamide |
1 |
A' |
3629 |
3564 |
0.982 |
158 |
495 |
|
|
2 |
A' |
3489 |
3439 |
0.986 |
158 |
496 |
|
|
3 |
A' |
2828 |
2854 |
1.009 |
158 |
497 |
|
|
4 |
A' |
1828 |
1754 |
0.960 |
158 |
498 |
|
|
5 |
A' |
1577 |
1577 |
1.000 |
158 |
499 |
|
|
6 |
A' |
1367 |
1390 |
1.017 |
158 |
500 |
|
|
7 |
A' |
1268 |
1258 |
0.993 |
158 |
501 |
|
|
8 |
A' |
1037 |
1046 |
1.008 |
158 |
502 |
|
|
9 |
A' |
550 |
581 |
1.056 |
158 |
503 |
|
|
10 |
A" |
996 |
1021 |
1.026 |
158 |
504 |
|
|
11 |
A" |
666 |
603 |
0.905 |
158 |
505 |
|
|
12 |
A" |
319 |
289 |
0.904 |
158 |
506 |
CH3SH |
Methanethiol |
1 |
A' |
3082 |
3000 |
0.973 |
159 |
507 |
|
|
2 |
A' |
2987 |
2931 |
0.981 |
159 |
508 |
|
|
3 |
A' |
2572 |
2597 |
1.010 |
159 |
509 |
|
|
4 |
A' |
1432 |
1475 |
1.030 |
159 |
510 |
|
|
5 |
A' |
1329 |
1335 |
1.004 |
159 |
511 |
|
|
6 |
A' |
1073 |
1074 |
1.001 |
159 |
512 |
|
|
7 |
A' |
789 |
803 |
1.018 |
159 |
513 |
|
|
8 |
A' |
718 |
708 |
0.986 |
159 |
514 |
|
|
9 |
A" |
3078 |
3000 |
0.975 |
159 |
515 |
|
|
10 |
A" |
1425 |
1430 |
1.004 |
159 |
516 |
|
|
11 |
A" |
957 |
976 |
1.020 |
159 |
517 |
PF5 |
Phosphorus pentafluoride |
1 |
A1' |
773 |
816 |
1.055 |
160 |
518 |
|
|
2 |
A1' |
643 |
648 |
1.007 |
160 |
519 |
|
|
3 |
A2" |
972 |
947 |
0.974 |
160 |
520 |
|
|
4 |
A2" |
539 |
575 |
1.067 |
160 |
521 |
|
|
5 |
E' |
998 |
1024 |
1.026 |
160 |
522 |
|
|
6 |
E' |
497 |
533 |
1.072 |
160 |
523 |
|
|
7 |
E' |
157 |
174 |
1.109 |
160 |
524 |
|
|
8 |
E" |
476 |
520 |
1.092 |
160 |
525 |
HSO3F |
Fluorosulfonic acid |
1 |
A |
3624 |
3602 |
0.994 |
161 |
526 |
|
|
2 |
A |
1464 |
1486 |
1.015 |
161 |
527 |
|
|
3 |
A |
1209 |
1243 |
1.028 |
161 |
528 |
|
|
4 |
A |
1098 |
1150 |
1.047 |
161 |
529 |
|
|
5 |
A |
856 |
896 |
1.046 |
161 |
530 |
|
|
6 |
A |
768 |
823 |
1.071 |
161 |
531 |
|
|
7 |
A |
506 |
562 |
1.110 |
161 |
532 |
|
|
8 |
A |
491 |
551 |
1.123 |
161 |
533 |
|
|
9 |
A |
474 |
518 |
1.093 |
161 |
534 |
|
|
10 |
A |
396 |
409 |
1.032 |
161 |
535 |
|
|
11 |
A |
341 |
390 |
1.145 |
161 |
536 |
|
|
12 |
A |
271 |
266 |
0.982 |
161 |
537 |
B2Cl4 |
Diboron tetrachloride |
1 |
A1 |
1148 |
1122 |
0.978 |
162 |
538 |
|
|
2 |
A1 |
409 |
401 |
0.980 |
162 |
539 |
|
|
3 |
A1 |
170 |
176 |
1.035 |
162 |
540 |
|
|
5 |
B2 |
738 |
728 |
0.986 |
162 |
541 |
|
|
6 |
B2 |
290 |
289 |
0.997 |
162 |
542 |
|
|
7 |
E |
931 |
917 |
0.985 |
162 |
543 |
|
|
8 |
E |
476 |
512 |
1.075 |
162 |
544 |
|
|
9 |
E |
88 |
104 |
1.188 |
162 |
545 |
PCl5 |
Phosphorus pentachloride |
1 |
A1' |
370 |
394 |
1.064 |
163 |
546 |
|
|
2 |
A1' |
267 |
264 |
0.988 |
163 |
547 |
|
|
3 |
A2" |
431 |
465 |
1.079 |
163 |
548 |
|
|
4 |
A2" |
287 |
299 |
1.043 |
163 |
549 |
|
|
5 |
E' |
541 |
592 |
1.094 |
163 |
550 |
|
|
7 |
E' |
259 |
273 |
1.053 |
163 |
551 |
|
|
8 |
E' |
84 |
100 |
1.196 |
163 |
552 |
|
|
9 |
E" |
249 |
282 |
1.131 |
163 |
553 |
CH2CCH2 |
allene |
1 |
A1 |
3055 |
3015 |
0.987 |
164 |
554 |
|
|
2 |
A1 |
1425 |
1443 |
1.013 |
164 |
555 |
|
|
3 |
A1 |
1099 |
1073 |
0.976 |
164 |
556 |
|
|
4 |
B1 |
864 |
865 |
1.001 |
164 |
557 |
|
|
5 |
B2 |
3051 |
3007 |
0.986 |
164 |
558 |
|
|
6 |
B2 |
2054 |
1957 |
0.953 |
164 |
559 |
|
|
7 |
B2 |
1356 |
1398 |
1.031 |
164 |
560 |
|
|
8 |
E |
3128 |
3086 |
0.986 |
164 |
561 |
|
|
9 |
E |
975 |
999 |
1.025 |
164 |
562 |
|
|
10 |
E |
804 |
841 |
1.045 |
164 |
563 |
|
|
11 |
E |
364 |
355 |
0.976 |
164 |
564 |
C3H4 |
cyclopropene |
1 |
A1 |
3219 |
3158 |
0.981 |
165 |
565 |
|
|
2 |
A1 |
2967 |
2909 |
0.980 |
165 |
566 |
|
|
3 |
A1 |
1719 |
1653 |
0.962 |
165 |
567 |
|
|
4 |
A1 |
1469 |
1483 |
1.009 |
165 |
568 |
|
|
5 |
A1 |
1168 |
1110 |
0.950 |
165 |
569 |
|
|
6 |
A1 |
879 |
905 |
1.029 |
165 |
570 |
|
|
7 |
A2 |
994 |
996 |
1.002 |
165 |
571 |
|
|
8 |
A2 |
815 |
820 |
1.006 |
165 |
572 |
|
|
9 |
B1 |
3033 |
2995 |
0.987 |
165 |
573 |
|
|
10 |
B1 |
1085 |
1088 |
1.003 |
165 |
574 |
|
|
11 |
B1 |
561 |
569 |
1.014 |
165 |
575 |
|
|
12 |
B2 |
3170 |
3124 |
0.985 |
165 |
576 |
|
|
13 |
B2 |
1031 |
1043 |
1.011 |
165 |
577 |
|
|
14 |
B2 |
984 |
1011 |
1.027 |
165 |
578 |
|
|
15 |
B2 |
786 |
769 |
0.978 |
165 |
579 |
CH3NH2 |
methyl amine |
1 |
A' |
3428 |
3361 |
0.980 |
166 |
580 |
|
|
2 |
A' |
2993 |
2961 |
0.989 |
166 |
581 |
|
|
3 |
A' |
2869 |
2820 |
0.983 |
166 |
582 |
|
|
4 |
A' |
1654 |
1623 |
0.981 |
166 |
583 |
|
|
5 |
A' |
1448 |
1473 |
1.017 |
166 |
584 |
|
|
6 |
A' |
1409 |
1430 |
1.015 |
166 |
585 |
|
|
7 |
A' |
1144 |
1130 |
0.988 |
166 |
586 |
|
|
8 |
A' |
1092 |
1044 |
0.956 |
166 |
587 |
|
|
9 |
A' |
810 |
780 |
0.962 |
166 |
588 |
|
|
10 |
A" |
3512 |
3427 |
0.976 |
166 |
589 |
|
|
11 |
A" |
3037 |
2985 |
0.983 |
166 |
590 |
|
|
12 |
A" |
1471 |
1485 |
1.010 |
166 |
591 |
|
|
13 |
A" |
1313 |
1335 |
1.017 |
166 |
592 |
|
|
14 |
A" |
959 |
|
|
166 |
593 |
|
|
15 |
A" |
334 |
268 |
0.803 |
166 |
594 |
CH2N4 |
1H-Tetrazole |
1 |
A' |
3559 |
3447 |
0.968 |
167 |
595 |
|
|
2 |
A' |
3205 |
3102 |
0.968 |
167 |
596 |
|
|
3 |
A' |
1483 |
1441 |
0.972 |
167 |
597 |
|
|
4 |
A' |
1440 |
1384 |
0.961 |
167 |
598 |
|
|
5 |
A' |
1283 |
1259 |
0.981 |
167 |
599 |
|
|
6 |
A' |
1240 |
1159 |
0.935 |
167 |
600 |
|
|
7 |
A' |
1130 |
1084 |
0.960 |
167 |
601 |
|
|
8 |
A' |
1079 |
1015 |
0.940 |
167 |
602 |
|
|
9 |
A' |
1057 |
1002 |
0.948 |
167 |
603 |
|
|
10 |
A' |
1004 |
969 |
0.965 |
167 |
604 |
|
|
11 |
A' |
963 |
925 |
0.961 |
167 |
605 |
|
|
12 |
A" |
807 |
906 |
1.122 |
167 |
606 |
|
|
13 |
A" |
740 |
663 |
0.896 |
167 |
607 |
|
|
14 |
A" |
694 |
658 |
0.948 |
167 |
608 |
|
|
15 |
A" |
632 |
578 |
0.915 |
167 |
609 |
CH3ONO |
Methyl nitrite |
1 |
A' |
3118 |
3037 |
0.974 |
168 |
610 |
|
|
2 |
A' |
2969 |
2950 |
0.994 |
168 |
611 |
|
|
3 |
A' |
1691 |
1613 |
0.954 |
168 |
612 |
|
|
4 |
A' |
1436 |
1454 |
1.013 |
168 |
613 |
|
|
5 |
A' |
1379 |
1408 |
1.021 |
168 |
614 |
|
|
6 |
A' |
1141 |
1239 |
1.086 |
168 |
615 |
|
|
7 |
A' |
1018 |
991 |
0.973 |
168 |
616 |
|
|
8 |
A' |
872 |
838 |
0.960 |
168 |
617 |
|
|
9 |
A' |
626 |
627 |
1.001 |
168 |
618 |
|
|
10 |
A' |
361 |
346 |
0.959 |
168 |
619 |
|
|
11 |
A" |
3038 |
2991 |
0.984 |
168 |
620 |
|
|
12 |
A" |
1412 |
1438 |
1.019 |
168 |
621 |
|
|
13 |
A" |
1122 |
1143 |
1.018 |
168 |
622 |
|
|
14 |
A" |
409 |
|
|
168 |
623 |
|
|
15 |
A" |
176 |
186 |
1.058 |
168 |
624 |
C2H4S |
Thiirane |
1 |
A1 |
3055 |
3014 |
0.987 |
169 |
625 |
|
|
2 |
A1 |
1444 |
1457 |
1.009 |
169 |
626 |
|
|
5 |
A1 |
664 |
627 |
0.945 |
169 |
627 |
|
|
11 |
B1 |
821 |
824 |
1.004 |
169 |
628 |
|
|
12 |
B2 |
3054 |
3013 |
0.986 |
169 |
629 |
|
|
14 |
B2 |
1027 |
1051 |
1.023 |
169 |
630 |
H2SO4 |
Sulfuric acid |
1 |
A |
3635 |
3563 |
0.980 |
170 |
631 |
|
|
2 |
A |
1191 |
1216 |
1.021 |
170 |
632 |
|
|
3 |
A |
1091 |
1136 |
1.041 |
170 |
633 |
|
|
4 |
A |
785 |
831 |
1.059 |
170 |
634 |
|
|
5 |
A |
504 |
548 |
1.088 |
170 |
635 |
|
|
6 |
A |
431 |
422 |
0.979 |
170 |
636 |
|
|
7 |
A |
354 |
379 |
1.069 |
170 |
637 |
|
|
8 |
A |
258 |
224 |
0.868 |
170 |
638 |
|
|
9 |
B |
3631 |
3567 |
0.982 |
170 |
639 |
|
|
10 |
B |
1449 |
1452 |
1.003 |
170 |
640 |
|
|
11 |
B |
1109 |
1157 |
1.043 |
170 |
641 |
|
|
12 |
B |
849 |
882 |
1.038 |
170 |
642 |
|
|
13 |
B |
514 |
558 |
1.087 |
170 |
643 |
|
|
14 |
B |
461 |
506 |
1.098 |
170 |
644 |
|
|
15 |
B |
322 |
288 |
0.894 |
170 |
645 |
CH3COF |
Acetyl fluoride |
1 |
A' |
3115 |
3043 |
0.977 |
171 |
646 |
|
|
2 |
A' |
2993 |
2955 |
0.987 |
171 |
647 |
|
|
3 |
A' |
1923 |
1870 |
0.972 |
171 |
648 |
|
|
4 |
A' |
1412 |
1440 |
1.020 |
171 |
649 |
|
|
5 |
A' |
1347 |
1378 |
1.023 |
171 |
650 |
|
|
6 |
A' |
1193 |
1188 |
0.996 |
171 |
651 |
|
|
7 |
A' |
977 |
1000 |
1.023 |
171 |
652 |
|
|
8 |
A' |
850 |
826 |
0.972 |
171 |
653 |
|
|
9 |
A' |
596 |
598 |
1.003 |
171 |
654 |
|
|
10 |
A' |
405 |
420 |
1.038 |
171 |
655 |
|
|
11 |
A" |
3063 |
3004 |
0.981 |
171 |
656 |
|
|
12 |
A" |
1414 |
1437 |
1.016 |
171 |
657 |
|
|
13 |
A" |
1028 |
1054 |
1.026 |
171 |
658 |
|
|
14 |
A" |
557 |
567 |
1.019 |
171 |
659 |
|
|
15 |
A" |
135 |
123 |
0.909 |
171 |
660 |
SF6 |
Sulfur Hexafluoride |
1 |
A1g |
709 |
774 |
1.091 |
172 |
661 |
|
|
2 |
Eg |
615 |
642 |
1.044 |
172 |
662 |
|
|
3 |
T1u |
915 |
948 |
1.036 |
172 |
663 |
|
|
4 |
T1u |
558 |
616 |
1.103 |
172 |
664 |
|
|
5 |
T2g |
469 |
525 |
1.118 |
172 |
665 |
|
|
6 |
T2u |
314 |
347 |
1.106 |
172 |
666 |
B2H6 |
Diborane |
1 |
Ag |
2551 |
2530 |
0.992 |
173 |
667 |
|
|
2 |
Ag |
2151 |
2088 |
0.971 |
173 |
668 |
|
|
3 |
Ag |
1126 |
1183 |
1.051 |
173 |
669 |
|
|
4 |
Ag |
818 |
790 |
0.966 |
173 |
670 |
|
|
5 |
Au |
836 |
833 |
0.997 |
173 |
671 |
|
|
6 |
B1g |
2632 |
2596 |
0.986 |
173 |
672 |
|
|
7 |
B1g |
899 |
915 |
1.018 |
173 |
673 |
|
|
8 |
B1u |
2039 |
1930 |
0.946 |
173 |
674 |
|
|
9 |
B1u |
931 |
973 |
1.045 |
173 |
675 |
|
|
10 |
B2g |
1872 |
1760 |
0.940 |
173 |
676 |
|
|
11 |
B2g |
887 |
860 |
0.970 |
173 |
677 |
|
|
12 |
B2u |
2646 |
2609 |
0.986 |
173 |
678 |
|
|
13 |
B2u |
826 |
949 |
1.149 |
173 |
679 |
|
|
14 |
B2u |
255 |
369 |
1.444 |
173 |
680 |
|
|
15 |
B3g |
915 |
1020 |
1.115 |
173 |
681 |
|
|
16 |
B3u |
2538 |
2520 |
0.993 |
173 |
682 |
|
|
17 |
B3u |
1677 |
1603 |
0.956 |
173 |
683 |
|
|
18 |
B3u |
1124 |
1172 |
1.043 |
173 |
684 |
C2H6 |
Ethane |
1 |
A1g |
2970 |
2954 |
0.995 |
174 |
685 |
|
|
2 |
A1g |
1374 |
1388 |
1.010 |
174 |
686 |
|
|
3 |
A1g |
1034 |
995 |
0.962 |
174 |
687 |
|
|
4 |
A1u |
312 |
289 |
0.928 |
174 |
688 |
|
|
5 |
A2u |
2974 |
2896 |
0.974 |
174 |
689 |
|
|
6 |
A2u |
1351 |
1379 |
1.021 |
174 |
690 |
|
|
7 |
Eg |
3032 |
2969 |
0.979 |
174 |
691 |
|
|
8 |
Eg |
1455 |
1468 |
1.009 |
174 |
692 |
|
|
9 |
Eg |
1172 |
1190 |
1.015 |
174 |
693 |
|
|
10 |
Eu |
3056 |
2985 |
0.977 |
174 |
694 |
|
|
11 |
Eu |
1455 |
1469 |
1.010 |
174 |
695 |
|
|
12 |
Eu |
799 |
822 |
1.029 |
174 |
696 |
C3H5 |
Allyl radical |
1 |
A1 |
3173 |
3114 |
0.981 |
175 |
697 |
|
|
2 |
A1 |
3071 |
3048 |
0.992 |
175 |
698 |
|
|
4 |
A1 |
1466 |
1488 |
1.015 |
175 |
699 |
|
|
5 |
A1 |
1251 |
1245 |
0.995 |
175 |
700 |
|
|
6 |
A1 |
1021 |
1066 |
1.044 |
175 |
701 |
|
|
7 |
A1 |
414 |
427 |
1.030 |
175 |
702 |
|
|
9 |
A2 |
528 |
549 |
1.040 |
175 |
703 |
|
|
10 |
B1 |
974 |
968 |
0.994 |
175 |
704 |
|
|
11 |
B1 |
785 |
802 |
1.021 |
175 |
705 |
|
|
12 |
B1 |
512 |
518 |
1.012 |
175 |
706 |
|
|
13 |
B2 |
3171 |
3105 |
0.979 |
175 |
707 |
|
|
14 |
B2 |
3067 |
3016 |
0.983 |
175 |
708 |
|
|
15 |
B2 |
1516 |
1463 |
0.965 |
175 |
709 |
|
|
16 |
B2 |
1371 |
1389 |
1.013 |
175 |
710 |
|
|
17 |
B2 |
1220 |
1182 |
0.969 |
175 |
711 |
Si2H6 |
disilane |
1 |
A1g |
2161 |
2152 |
0.996 |
176 |
712 |
|
|
2 |
A1g |
857 |
909 |
1.060 |
176 |
713 |
|
|
3 |
A1g |
432 |
434 |
1.005 |
176 |
714 |
|
|
4 |
A1u |
145 |
131 |
0.905 |
176 |
715 |
|
|
5 |
A2u |
2156 |
2154 |
0.999 |
176 |
716 |
|
|
6 |
A2u |
787 |
844 |
1.072 |
176 |
717 |
|
|
7 |
Eg |
2171 |
2155 |
0.993 |
176 |
718 |
|
|
8 |
Eg |
892 |
929 |
1.042 |
176 |
719 |
|
|
9 |
Eg |
603 |
625 |
1.037 |
176 |
720 |
|
|
10 |
Eu |
2180 |
2179 |
0.999 |
176 |
721 |
|
|
11 |
Eu |
904 |
940 |
1.039 |
176 |
722 |
|
|
12 |
Eu |
346 |
379 |
1.095 |
176 |
723 |
C3H3NO |
Oxazole |
1 |
A' |
3219 |
3170 |
0.985 |
177 |
724 |
|
|
2 |
A' |
3197 |
3144 |
0.983 |
177 |
725 |
|
|
3 |
A' |
3179 |
3141 |
0.988 |
177 |
726 |
|
|
4 |
A' |
1558 |
1537 |
0.986 |
177 |
727 |
|
|
5 |
A' |
1515 |
1504 |
0.993 |
177 |
728 |
|
|
6 |
A' |
1347 |
1324 |
0.983 |
177 |
729 |
|
|
7 |
A' |
1223 |
1252 |
1.023 |
177 |
730 |
|
|
8 |
A' |
1160 |
1139 |
0.982 |
177 |
731 |
|
|
9 |
A' |
1157 |
1086 |
0.938 |
177 |
732 |
|
|
10 |
A' |
1082 |
1078 |
0.996 |
177 |
733 |
|
|
11 |
A' |
1074 |
1046 |
0.973 |
177 |
734 |
|
|
12 |
A' |
918 |
899 |
0.979 |
177 |
735 |
|
|
13 |
A' |
903 |
854 |
0.945 |
177 |
736 |
|
|
14 |
A" |
836 |
907 |
1.085 |
177 |
737 |
|
|
15 |
A" |
790 |
830 |
1.051 |
177 |
738 |
|
|
16 |
A" |
727 |
750 |
1.032 |
177 |
739 |
|
|
17 |
A" |
665 |
647 |
0.974 |
177 |
740 |
|
|
18 |
A" |
629 |
607 |
0.965 |
177 |
741 |
CH3NO3 |
Methyl nitrate |
1 |
A' |
3094 |
3008 |
0.972 |
178 |
742 |
|
|
2 |
A' |
2973 |
2941 |
0.989 |
178 |
743 |
|
|
3 |
A' |
1792 |
1678 |
0.937 |
178 |
744 |
|
|
4 |
A' |
1452 |
1468 |
1.011 |
178 |
745 |
|
|
5 |
A' |
1412 |
1430 |
1.013 |
178 |
746 |
|
|
6 |
A' |
1337 |
1287 |
0.963 |
178 |
747 |
|
|
7 |
A' |
1152 |
1176 |
1.021 |
178 |
748 |
|
|
8 |
A' |
1055 |
1017 |
0.964 |
178 |
749 |
|
|
9 |
A' |
850 |
854 |
1.005 |
178 |
750 |
|
|
10 |
A' |
666 |
657 |
0.986 |
178 |
751 |
|
|
11 |
A' |
571 |
578 |
1.012 |
178 |
752 |
|
|
12 |
A' |
348 |
340 |
0.978 |
178 |
753 |
|
|
13 |
A" |
3054 |
3008 |
0.985 |
178 |
754 |
|
|
14 |
A" |
1413 |
1455 |
1.030 |
178 |
755 |
|
|
15 |
A" |
1139 |
1136 |
0.997 |
178 |
756 |
|
|
16 |
A" |
768 |
758 |
0.986 |
178 |
757 |
|
|
17 |
A" |
204 |
|
|
178 |
758 |
|
|
18 |
A" |
157 |
|
|
178 |
759 |
CH3CF3 |
Ethane, 1,1,1-trifluoro- |
1 |
A1 |
3006 |
2974 |
0.989 |
179 |
760 |
|
|
2 |
A1 |
1392 |
1412 |
1.014 |
179 |
761 |
|
|
3 |
A1 |
1271 |
1278 |
1.006 |
179 |
762 |
|
|
4 |
A1 |
844 |
828 |
0.981 |
179 |
763 |
|
|
5 |
A1 |
596 |
606 |
1.016 |
179 |
764 |
|
|
6 |
A2 |
248 |
225 |
0.908 |
179 |
765 |
|
|
7 |
E |
3100 |
3042 |
0.981 |
179 |
766 |
|
|
8 |
E |
1427 |
1450 |
1.016 |
179 |
767 |
|
|
9 |
E |
1223 |
1230 |
1.006 |
179 |
768 |
|
|
10 |
E |
944 |
964 |
1.021 |
179 |
769 |
|
|
11 |
E |
531 |
540 |
1.017 |
179 |
770 |
|
|
12 |
E |
355 |
365 |
1.029 |
179 |
771 |
CH2ClCH2Cl |
Ethane, 1,2-dichloro- |
1 |
A |
3060 |
3005 |
0.982 |
180 |
772 |
|
|
2 |
A |
3007 |
2957 |
0.983 |
180 |
773 |
|
|
3 |
A |
1405 |
1433 |
1.020 |
180 |
774 |
|
|
4 |
A |
1313 |
1315 |
1.002 |
180 |
775 |
|
|
5 |
A |
1212 |
1207 |
0.996 |
180 |
776 |
|
|
6 |
A |
1058 |
1027 |
0.971 |
180 |
777 |
|
|
7 |
A |
945 |
948 |
1.004 |
180 |
778 |
|
|
8 |
A |
678 |
669 |
0.987 |
180 |
779 |
|
|
9 |
A |
263 |
272 |
1.033 |
180 |
780 |
|
|
10 |
A |
123 |
125 |
1.013 |
180 |
781 |
|
|
11 |
B |
3074 |
3005 |
0.978 |
180 |
782 |
|
|
12 |
B |
3001 |
2957 |
0.985 |
180 |
783 |
|
|
13 |
B |
1400 |
1436 |
1.025 |
180 |
784 |
|
|
14 |
B |
1283 |
1292 |
1.007 |
180 |
785 |
|
|
15 |
B |
1144 |
1146 |
1.002 |
180 |
786 |
|
|
16 |
B |
879 |
890 |
1.013 |
180 |
787 |
|
|
17 |
B |
692 |
693 |
1.001 |
180 |
788 |
|
|
18 |
B |
408 |
410 |
1.005 |
180 |
789 |
C3H4N2 |
1H-Imidazole |
1 |
A' |
3559 |
3517 |
0.988 |
181 |
790 |
|
|
2 |
A' |
3198 |
3143 |
0.983 |
181 |
791 |
|
|
3 |
A' |
3170 |
3123 |
0.985 |
181 |
792 |
|
|
4 |
A' |
3164 |
3110 |
0.983 |
181 |
793 |
|
|
5 |
A' |
1535 |
1448 |
0.944 |
181 |
794 |
|
|
6 |
A' |
1489 |
1404 |
0.943 |
181 |
795 |
|
|
7 |
A' |
1433 |
1328 |
0.927 |
181 |
796 |
|
|
8 |
A' |
1372 |
1265 |
0.922 |
181 |
797 |
|
|
9 |
A' |
1240 |
1188 |
0.958 |
181 |
798 |
|
|
10 |
A' |
1197 |
1098 |
0.917 |
181 |
799 |
|
|
11 |
A' |
1122 |
1062 |
0.947 |
181 |
800 |
|
|
12 |
A' |
1082 |
1013 |
0.936 |
181 |
801 |
|
|
13 |
A' |
1056 |
988 |
0.936 |
181 |
802 |
|
|
14 |
A' |
930 |
923 |
0.993 |
181 |
803 |
|
|
15 |
A' |
886 |
898 |
1.013 |
181 |
804 |
|
|
16 |
A" |
823 |
831 |
1.009 |
181 |
805 |
|
|
17 |
A" |
762 |
758 |
0.995 |
181 |
806 |
|
|
18 |
A" |
685 |
674 |
0.984 |
181 |
807 |
|
|
19 |
A" |
679 |
663 |
0.976 |
181 |
808 |
|
|
20 |
A" |
644 |
621 |
0.964 |
181 |
809 |
|
|
21 |
A" |
558 |
539 |
0.965 |
181 |
810 |
CH3CH2SH |
ethanethiol |
1 |
A |
3062 |
2980 |
0.973 |
182 |
811 |
|
|
2 |
A |
3043 |
2967 |
0.975 |
182 |
812 |
|
|
3 |
A |
3030 |
2930 |
0.967 |
182 |
813 |
|
|
4 |
A |
2991 |
2902 |
0.970 |
182 |
814 |
|
|
5 |
A |
2965 |
2875 |
0.970 |
182 |
815 |
|
|
6 |
A |
2560 |
2591 |
1.012 |
182 |
816 |
|
|
7 |
A |
1445 |
1462 |
1.012 |
182 |
817 |
|
|
8 |
A |
1436 |
1452 |
1.011 |
182 |
818 |
|
|
9 |
A |
1423 |
1437 |
1.010 |
182 |
819 |
|
|
10 |
A |
1359 |
1377 |
1.013 |
182 |
820 |
|
|
11 |
A |
1269 |
1269 |
1.000 |
182 |
821 |
|
|
12 |
A |
1244 |
1246 |
1.002 |
182 |
822 |
|
|
13 |
A |
1101 |
1093 |
0.993 |
182 |
823 |
|
|
14 |
A |
1063 |
1051 |
0.989 |
182 |
824 |
|
|
15 |
A |
980 |
970 |
0.990 |
182 |
825 |
|
|
16 |
A |
850 |
867 |
1.020 |
182 |
826 |
|
|
17 |
A |
727 |
735 |
1.011 |
182 |
827 |
|
|
18 |
A |
665 |
658 |
0.989 |
182 |
828 |
|
|
19 |
A |
328 |
319 |
0.973 |
182 |
829 |
|
|
20 |
A |
277 |
|
|
182 |
830 |
|
|
21 |
A |
222 |
|
|
182 |
831 |
CHCCH2CH3 |
1-Butyne |
1 |
A' |
3390 |
3332 |
0.983 |
183 |
832 |
|
|
2 |
A' |
3064 |
2988 |
0.975 |
183 |
833 |
|
|
3 |
A' |
2982 |
|
|
183 |
834 |
|
|
4 |
A' |
2956 |
|
|
183 |
835 |
|
|
5 |
A' |
2195 |
2116 |
0.964 |
183 |
836 |
|
|
6 |
A' |
1453 |
1470 |
1.012 |
183 |
837 |
|
|
7 |
A' |
1416 |
1446 |
1.021 |
183 |
838 |
|
|
8 |
A' |
1357 |
1385 |
1.020 |
183 |
839 |
|
|
9 |
A' |
1304 |
1322 |
1.014 |
183 |
840 |
|
|
10 |
A' |
1069 |
1070 |
1.001 |
183 |
841 |
|
|
11 |
A' |
1037 |
1008 |
0.972 |
183 |
842 |
|
|
12 |
A' |
860 |
840 |
0.976 |
183 |
843 |
|
|
13 |
A' |
584 |
634 |
1.086 |
183 |
844 |
|
|
14 |
A' |
510 |
509 |
0.999 |
183 |
845 |
|
|
15 |
A' |
189 |
197 |
1.041 |
183 |
846 |
|
|
16 |
A" |
3066 |
2988 |
0.974 |
183 |
847 |
|
|
17 |
A" |
2986 |
2939 |
0.984 |
183 |
848 |
|
|
18 |
A" |
1441 |
1462 |
1.015 |
183 |
849 |
|
|
19 |
A" |
1247 |
1261 |
1.011 |
183 |
850 |
|
|
20 |
A" |
1065 |
1090 |
1.023 |
183 |
851 |
|
|
21 |
A" |
761 |
782 |
1.027 |
183 |
852 |
|
|
22 |
A" |
570 |
630 |
1.104 |
183 |
853 |
|
|
23 |
A" |
353 |
344 |
0.972 |
183 |
854 |
|
|
24 |
A" |
217 |
213 |
0.981 |
183 |
855 |
CH3CCCH3 |
2-Butyne |
1 |
A1' |
2954 |
2916 |
0.987 |
184 |
856 |
|
|
2 |
A1' |
2339 |
2240 |
0.958 |
184 |
857 |
|
|
3 |
A1' |
1360 |
1380 |
1.015 |
184 |
858 |
|
|
4 |
A1' |
745 |
725 |
0.973 |
184 |
859 |
|
|
6 |
A2" |
2955 |
2938 |
0.994 |
184 |
860 |
|
|
7 |
A2" |
1369 |
1382 |
1.009 |
184 |
861 |
|
|
8 |
A2" |
1201 |
1152 |
0.959 |
184 |
862 |
|
|
9 |
E' |
3021 |
2973 |
0.984 |
184 |
863 |
|
|
10 |
E' |
1423 |
1456 |
1.023 |
184 |
864 |
|
|
11 |
E' |
1019 |
1054 |
1.034 |
184 |
865 |
|
|
12 |
E' |
199 |
213 |
1.072 |
184 |
866 |
|
|
13 |
E" |
3022 |
2966 |
0.981 |
184 |
867 |
|
|
14 |
E" |
1424 |
1448 |
1.017 |
184 |
868 |
|
|
15 |
E" |
991 |
1029 |
1.039 |
184 |
869 |
|
|
16 |
E" |
370 |
371 |
1.003 |
184 |
870 |
CH2CCHCH3 |
1,2-Butadiene |
1 |
A' |
3069 |
3061 |
0.997 |
185 |
871 |
|
|
2 |
A' |
3043 |
3010 |
0.989 |
185 |
872 |
|
|
3 |
A' |
3040 |
2965 |
0.975 |
185 |
873 |
|
|
4 |
A' |
2961 |
2905 |
0.981 |
185 |
874 |
|
|
5 |
A' |
2057 |
1970 |
0.958 |
185 |
875 |
|
|
6 |
A' |
1460 |
1453 |
0.995 |
185 |
876 |
|
|
7 |
A' |
1417 |
1437 |
1.014 |
185 |
877 |
|
|
8 |
A' |
1351 |
1389 |
1.028 |
185 |
878 |
|
|
9 |
A' |
1313 |
1330 |
1.013 |
185 |
879 |
|
|
10 |
A' |
1137 |
1132 |
0.995 |
185 |
880 |
|
|
11 |
A' |
1062 |
1074 |
1.012 |
185 |
881 |
|
|
12 |
A' |
878 |
876 |
0.998 |
185 |
882 |
|
|
13 |
A' |
815 |
859 |
1.054 |
185 |
883 |
|
|
14 |
A' |
562 |
555 |
0.987 |
185 |
884 |
|
|
15 |
A' |
201 |
210 |
1.043 |
185 |
885 |
|
|
16 |
A" |
3115 |
3061 |
0.983 |
185 |
886 |
|
|
17 |
A" |
3020 |
2965 |
0.982 |
185 |
887 |
|
|
18 |
A" |
1428 |
1453 |
1.017 |
185 |
888 |
|
|
19 |
A" |
1014 |
1110 |
1.095 |
185 |
889 |
|
|
20 |
A" |
979 |
1011 |
1.033 |
185 |
890 |
|
|
21 |
A" |
864 |
842 |
0.975 |
185 |
891 |
|
|
22 |
A" |
526 |
523 |
0.994 |
185 |
892 |
|
|
23 |
A" |
333 |
322 |
0.968 |
185 |
893 |
C4H6 |
Cyclobutene |
1 |
A1 |
3126 |
3060 |
0.979 |
186 |
894 |
|
|
2 |
A1 |
2973 |
2935 |
0.987 |
186 |
895 |
|
|
3 |
A1 |
1615 |
1570 |
0.972 |
186 |
896 |
|
|
4 |
A1 |
1427 |
1450 |
1.016 |
186 |
897 |
|
|
5 |
A1 |
1172 |
1276 |
1.089 |
186 |
898 |
|
|
6 |
A1 |
1131 |
1186 |
1.049 |
186 |
899 |
|
|
7 |
A1 |
983 |
1113 |
1.132 |
186 |
900 |
|
|
8 |
A1 |
912 |
886 |
0.972 |
186 |
901 |
|
|
9 |
A2 |
3012 |
2955 |
0.981 |
186 |
902 |
|
|
10 |
A2 |
1129 |
1276 |
1.130 |
186 |
903 |
|
|
11 |
A2 |
1001 |
1081 |
1.080 |
186 |
904 |
|
|
12 |
A2 |
888 |
850 |
0.957 |
186 |
905 |
|
|
13 |
A2 |
313 |
325 |
1.037 |
186 |
906 |
|
|
14 |
B1 |
3025 |
2955 |
0.977 |
186 |
907 |
|
|
15 |
B1 |
1065 |
1074 |
1.008 |
186 |
908 |
|
|
16 |
B1 |
839 |
846 |
1.009 |
186 |
909 |
|
|
17 |
B1 |
615 |
635 |
1.032 |
186 |
910 |
|
|
18 |
B2 |
3094 |
3047 |
0.985 |
186 |
911 |
|
|
19 |
B2 |
2969 |
2916 |
0.982 |
186 |
912 |
|
|
20 |
B2 |
1401 |
1427 |
1.019 |
186 |
913 |
|
|
21 |
B2 |
1286 |
1294 |
1.006 |
186 |
914 |
|
|
22 |
B2 |
1182 |
1214 |
1.027 |
186 |
915 |
|
|
23 |
B2 |
900 |
888 |
0.987 |
186 |
916 |
|
|
24 |
B2 |
846 |
740 |
0.875 |
186 |
917 |
C4H6 |
Methylenecyclopropane |
1 |
A1 |
3054 |
3010 |
0.986 |
187 |
918 |
|
|
2 |
A1 |
3037 |
3002 |
0.988 |
187 |
919 |
|
|
3 |
A1 |
1841 |
1743 |
0.947 |
187 |
920 |
|
|
4 |
A1 |
1425 |
1437 |
1.009 |
187 |
921 |
|
|
5 |
A1 |
1382 |
1410 |
1.020 |
187 |
922 |
|
|
6 |
A1 |
1083 |
1036 |
0.957 |
187 |
923 |
|
|
7 |
A1 |
981 |
1002 |
1.022 |
187 |
924 |
|
|
8 |
A1 |
759 |
723 |
0.953 |
187 |
925 |
|
|
9 |
A2 |
3111 |
3051 |
0.981 |
187 |
926 |
|
|
10 |
A2 |
1130 |
1144 |
1.012 |
187 |
927 |
|
|
11 |
A2 |
927 |
937 |
1.011 |
187 |
928 |
|
|
12 |
A2 |
595 |
616 |
1.035 |
187 |
929 |
|
|
13 |
B1 |
3124 |
3071 |
0.983 |
187 |
930 |
|
|
14 |
B1 |
1059 |
1072 |
1.012 |
187 |
931 |
|
|
15 |
B1 |
861 |
889 |
1.032 |
187 |
932 |
|
|
16 |
B1 |
737 |
748 |
1.014 |
187 |
933 |
|
|
17 |
B1 |
279 |
360 |
1.293 |
187 |
934 |
|
|
18 |
B2 |
3139 |
3086 |
0.983 |
187 |
935 |
|
|
19 |
B2 |
3037 |
2999 |
0.988 |
187 |
936 |
|
|
20 |
B2 |
1383 |
1353 |
0.978 |
187 |
937 |
|
|
21 |
B2 |
1118 |
1174 |
1.050 |
187 |
938 |
|
|
22 |
B2 |
1020 |
1125 |
1.103 |
187 |
939 |
|
|
23 |
B2 |
891 |
792 |
0.889 |
187 |
940 |
|
|
24 |
B2 |
345 |
290 |
0.841 |
187 |
941 |
C4H6 |
Bicyclo[1.1.0]butane |
1 |
A1 |
3175 |
3131 |
0.986 |
188 |
942 |
|
|
2 |
A1 |
3097 |
3044 |
0.983 |
188 |
943 |
|
|
3 |
A1 |
2977 |
2935 |
0.986 |
188 |
944 |
|
|
4 |
A1 |
1480 |
1501 |
1.015 |
188 |
945 |
|
|
5 |
A1 |
1293 |
1266 |
0.979 |
188 |
946 |
|
|
6 |
A1 |
1084 |
1081 |
0.997 |
188 |
947 |
|
|
7 |
A1 |
889 |
839 |
0.943 |
188 |
948 |
|
|
8 |
A1 |
665 |
657 |
0.988 |
188 |
949 |
|
|
9 |
A1 |
419 |
423 |
1.008 |
188 |
950 |
|
|
10 |
A2 |
1136 |
1172 |
1.032 |
188 |
951 |
|
|
11 |
A2 |
1033 |
1063 |
1.029 |
188 |
952 |
|
|
12 |
A2 |
913 |
909 |
0.995 |
188 |
953 |
|
|
13 |
A2 |
850 |
838 |
0.986 |
188 |
954 |
|
|
14 |
B1 |
3162 |
3120 |
0.987 |
188 |
955 |
|
|
15 |
B1 |
1148 |
1110 |
0.967 |
188 |
956 |
|
|
16 |
B1 |
1089 |
1092 |
1.003 |
188 |
957 |
|
|
17 |
B1 |
960 |
980 |
1.021 |
188 |
958 |
|
|
18 |
B1 |
759 |
737 |
0.971 |
188 |
959 |
|
|
19 |
B2 |
3100 |
3044 |
0.982 |
188 |
960 |
|
|
20 |
B2 |
2984 |
2969 |
0.995 |
188 |
961 |
|
|
21 |
B2 |
1429 |
1485 |
1.039 |
188 |
962 |
|
|
22 |
B2 |
1306 |
1261 |
0.966 |
188 |
963 |
|
|
23 |
B2 |
1081 |
1081 |
0.999 |
188 |
964 |
|
|
24 |
B2 |
919 |
935 |
1.017 |
188 |
965 |
C4H5N |
Cyclopropanecarbonitrile |
1 |
A' |
3175 |
3120 |
0.983 |
189 |
966 |
|
|
2 |
A' |
3094 |
3052 |
0.986 |
189 |
967 |
|
|
3 |
A' |
3079 |
3044 |
0.989 |
189 |
968 |
|
|
4 |
A' |
2316 |
2264 |
0.978 |
189 |
969 |
|
|
5 |
A' |
1458 |
1468 |
1.007 |
189 |
970 |
|
|
6 |
A' |
1356 |
1344 |
0.991 |
189 |
971 |
|
|
7 |
A' |
1212 |
1195 |
0.986 |
189 |
972 |
|
|
8 |
A' |
1113 |
1125 |
1.011 |
189 |
973 |
|
|
9 |
A' |
1017 |
1049 |
1.031 |
189 |
974 |
|
|
10 |
A' |
980 |
941 |
0.960 |
189 |
975 |
|
|
11 |
A' |
807 |
808 |
1.001 |
189 |
976 |
|
|
12 |
A' |
754 |
736 |
0.976 |
189 |
977 |
|
|
13 |
A' |
533 |
527 |
0.990 |
189 |
978 |
|
|
14 |
A' |
208 |
222 |
1.065 |
189 |
979 |
|
|
15 |
A" |
3162 |
3094 |
0.979 |
189 |
980 |
|
|
16 |
A" |
3076 |
3040 |
0.988 |
189 |
981 |
|
|
17 |
A" |
1407 |
1442 |
1.025 |
189 |
982 |
|
|
18 |
A" |
1162 |
1180 |
1.016 |
189 |
983 |
|
|
19 |
A" |
1061 |
1070 |
1.008 |
189 |
984 |
|
|
20 |
A" |
1035 |
1088 |
1.052 |
189 |
985 |
|
|
21 |
A" |
901 |
880 |
0.977 |
189 |
986 |
|
|
22 |
A" |
813 |
821 |
1.010 |
189 |
987 |
|
|
23 |
A" |
554 |
543 |
0.981 |
189 |
988 |
|
|
24 |
A" |
211 |
222 |
1.051 |
189 |
989 |
C3H6O |
2-Propen-1-ol |
1 |
A |
3703 |
3675 |
0.992 |
190 |
990 |
|
|
2 |
A |
3151 |
3102 |
0.985 |
190 |
991 |
|
|
3 |
A |
3074 |
3022 |
0.983 |
190 |
992 |
|
|
4 |
A |
3057 |
2995 |
0.980 |
190 |
993 |
|
|
5 |
A |
2903 |
2934 |
1.011 |
190 |
994 |
|
|
6 |
A |
2869 |
2866 |
0.999 |
190 |
995 |
|
|
7 |
A |
1705 |
1654 |
0.970 |
190 |
996 |
|
|
8 |
A |
1448 |
1453 |
1.003 |
190 |
997 |
|
|
9 |
A |
1424 |
1414 |
0.993 |
190 |
998 |
|
|
10 |
A |
1369 |
1384 |
1.011 |
190 |
999 |
|
|
11 |
A |
1260 |
1320 |
1.048 |
190 |
1000 |
|
|
12 |
A |
1241 |
1293 |
1.042 |
190 |
1001 |
|
|
13 |
A |
1198 |
1191 |
0.994 |
190 |
1002 |
|
|
14 |
A |
1134 |
1132 |
0.998 |
190 |
1003 |
|
|
15 |
A |
1093 |
1110 |
1.015 |
190 |
1004 |
|
|
16 |
A |
990 |
1038 |
1.048 |
190 |
1005 |
|
|
17 |
A |
937 |
995 |
1.061 |
190 |
1006 |
|
|
18 |
A |
906 |
919 |
1.014 |
190 |
1007 |
|
|
19 |
A |
895 |
885 |
0.988 |
190 |
1008 |
|
|
20 |
A |
638 |
606 |
0.950 |
190 |
1009 |
|
|
22 |
A |
315 |
377 |
1.196 |
190 |
1010 |
|
|
23 |
A |
270 |
277 |
1.027 |
190 |
1011 |
|
|
24 |
A |
122 |
188 |
1.543 |
190 |
1012 |
CH3SSCH3 |
Disulfide, dimethyl |
1 |
A |
3076 |
2990 |
0.972 |
191 |
1013 |
|
|
2 |
A |
3058 |
2983 |
0.976 |
191 |
1014 |
|
|
3 |
A |
2971 |
2913 |
0.981 |
191 |
1015 |
|
|
4 |
A |
1411 |
1426 |
1.011 |
191 |
1016 |
|
|
5 |
A |
1408 |
1419 |
1.008 |
191 |
1017 |
|
|
6 |
A |
1317 |
1311 |
0.995 |
191 |
1018 |
|
|
7 |
A |
958 |
955 |
0.997 |
191 |
1019 |
|
|
8 |
A |
945 |
949 |
1.005 |
191 |
1020 |
|
|
9 |
A |
706 |
694 |
0.983 |
191 |
1021 |
|
|
10 |
A |
491 |
509 |
1.036 |
191 |
1022 |
|
|
11 |
A |
231 |
240 |
1.039 |
191 |
1023 |
|
|
12 |
A |
156 |
134 |
0.861 |
191 |
1024 |
|
|
13 |
A |
88 |
117 |
1.330 |
191 |
1025 |
|
|
14 |
B |
3076 |
2990 |
0.972 |
191 |
1026 |
|
|
15 |
B |
3061 |
2983 |
0.974 |
191 |
1027 |
|
|
16 |
B |
2970 |
2915 |
0.982 |
191 |
1028 |
|
|
17 |
B |
1419 |
1430 |
1.008 |
191 |
1029 |
|
|
18 |
B |
1398 |
1415 |
1.012 |
191 |
1030 |
|
|
19 |
B |
1307 |
1303 |
0.997 |
191 |
1031 |
|
|
20 |
B |
957 |
955 |
0.998 |
191 |
1032 |
|
|
21 |
B |
947 |
949 |
1.002 |
191 |
1033 |
|
|
22 |
B |
706 |
691 |
0.979 |
191 |
1034 |
|
|
23 |
B |
262 |
274 |
1.044 |
191 |
1035 |
|
|
24 |
B |
180 |
134 |
0.746 |
191 |
1036 |
C3H8 |
Propane |
1 |
A1 |
3046 |
2977 |
0.977 |
192 |
1037 |
|
|
2 |
A1 |
2964 |
2962 |
0.999 |
192 |
1038 |
|
|
3 |
A1 |
2957 |
2887 |
0.976 |
192 |
1039 |
|
|
4 |
A1 |
1461 |
1476 |
1.010 |
192 |
1040 |
|
|
5 |
A1 |
1435 |
1462 |
1.019 |
192 |
1041 |
|
|
6 |
A1 |
1366 |
1392 |
1.019 |
192 |
1042 |
|
|
7 |
A1 |
1145 |
1158 |
1.012 |
192 |
1043 |
|
|
8 |
A1 |
893 |
869 |
0.973 |
192 |
1044 |
|
|
9 |
A1 |
360 |
369 |
1.025 |
192 |
1045 |
|
|
10 |
A2 |
3029 |
2967 |
0.980 |
192 |
1046 |
|
|
11 |
A2 |
1432 |
1451 |
1.013 |
192 |
1047 |
|
|
12 |
A2 |
1276 |
1278 |
1.002 |
192 |
1048 |
|
|
13 |
A2 |
882 |
940 |
1.065 |
192 |
1049 |
|
|
14 |
A2 |
218 |
216 |
0.992 |
192 |
1050 |
|
|
15 |
B1 |
3037 |
2973 |
0.979 |
192 |
1051 |
|
|
16 |
B1 |
2988 |
2968 |
0.993 |
192 |
1052 |
|
|
17 |
B1 |
1455 |
1472 |
1.012 |
192 |
1053 |
|
|
18 |
B1 |
1168 |
1192 |
1.020 |
192 |
1054 |
|
|
19 |
B1 |
731 |
748 |
1.023 |
192 |
1055 |
|
|
20 |
B1 |
275 |
268 |
0.976 |
192 |
1056 |
|
|
21 |
B2 |
3045 |
2968 |
0.975 |
192 |
1057 |
|
|
22 |
B2 |
2960 |
2887 |
0.975 |
192 |
1058 |
|
|
23 |
B2 |
1442 |
1464 |
1.015 |
192 |
1059 |
|
|
24 |
B2 |
1354 |
1378 |
1.018 |
192 |
1060 |
|
|
25 |
B2 |
1315 |
1338 |
1.017 |
192 |
1061 |
|
|
26 |
B2 |
1082 |
1054 |
0.974 |
192 |
1062 |
|
|
27 |
B2 |
897 |
922 |
1.028 |
192 |
1063 |
C5H6 |
1,3-Cyclopentadiene |
1 |
A1 |
3158 |
3091 |
0.979 |
193 |
1064 |
|
|
2 |
A1 |
3133 |
3075 |
0.981 |
193 |
1065 |
|
|
3 |
A1 |
2953 |
2886 |
0.977 |
193 |
1066 |
|
|
4 |
A1 |
1534 |
1500 |
0.978 |
193 |
1067 |
|
|
5 |
A1 |
1376 |
1378 |
1.002 |
193 |
1068 |
|
|
6 |
A1 |
1335 |
1365 |
1.023 |
193 |
1069 |
|
|
7 |
A1 |
1099 |
1106 |
1.006 |
193 |
1070 |
|
|
8 |
A1 |
1025 |
994 |
0.970 |
193 |
1071 |
|
|
9 |
A1 |
935 |
915 |
0.979 |
193 |
1072 |
|
|
10 |
A1 |
805 |
802 |
0.996 |
193 |
1073 |
|
|
11 |
A2 |
1075 |
1100 |
1.023 |
193 |
1074 |
|
|
12 |
A2 |
905 |
941 |
1.039 |
193 |
1075 |
|
|
13 |
A2 |
674 |
700 |
1.039 |
193 |
1076 |
|
|
14 |
A2 |
515 |
516 |
1.001 |
193 |
1077 |
|
|
15 |
B1 |
2982 |
2900 |
0.973 |
193 |
1078 |
|
|
16 |
B1 |
895 |
925 |
1.033 |
193 |
1079 |
|
|
17 |
B1 |
863 |
891 |
1.033 |
193 |
1080 |
|
|
18 |
B1 |
654 |
664 |
1.016 |
193 |
1081 |
|
|
19 |
B1 |
328 |
350 |
1.067 |
193 |
1082 |
|
|
20 |
B2 |
3152 |
3105 |
0.985 |
193 |
1083 |
|
|
21 |
B2 |
3122 |
3043 |
0.975 |
193 |
1084 |
|
|
22 |
B2 |
1615 |
1580 |
0.978 |
193 |
1085 |
|
|
23 |
B2 |
1286 |
1292 |
1.005 |
193 |
1086 |
|
|
24 |
B2 |
1221 |
1239 |
1.015 |
193 |
1087 |
|
|
25 |
B2 |
1068 |
1090 |
1.021 |
193 |
1088 |
|
|
26 |
B2 |
963 |
959 |
0.996 |
193 |
1089 |
|
|
27 |
B2 |
804 |
805 |
1.001 |
193 |
1090 |
CHOCHCHCH3 |
2-Butenal |
1 |
A' |
3084 |
3058 |
0.992 |
194 |
1091 |
|
|
2 |
A' |
3063 |
2995 |
0.978 |
194 |
1092 |
|
|
3 |
A' |
3029 |
2963 |
0.978 |
194 |
1093 |
|
|
4 |
A' |
2958 |
2938 |
0.993 |
194 |
1094 |
|
|
5 |
A' |
2737 |
2805 |
1.025 |
194 |
1095 |
|
|
6 |
A' |
1776 |
1720 |
0.968 |
194 |
1096 |
|
|
7 |
A' |
1695 |
1649 |
0.973 |
194 |
1097 |
|
|
8 |
A' |
1428 |
1455 |
1.019 |
194 |
1098 |
|
|
9 |
A' |
1365 |
1391 |
1.019 |
194 |
1099 |
|
|
10 |
A' |
1354 |
1375 |
1.016 |
194 |
1100 |
|
|
11 |
A' |
1284 |
1304 |
1.016 |
194 |
1101 |
|
|
12 |
A' |
1228 |
1253 |
1.021 |
194 |
1102 |
|
|
13 |
A' |
1143 |
1147 |
1.003 |
194 |
1103 |
|
|
14 |
A' |
1114 |
1074 |
0.964 |
194 |
1104 |
|
|
15 |
A' |
921 |
973 |
1.056 |
194 |
1105 |
|
|
16 |
A' |
536 |
539 |
1.006 |
194 |
1106 |
|
|
17 |
A' |
456 |
464 |
1.017 |
194 |
1107 |
|
|
18 |
A' |
204 |
230 |
1.129 |
194 |
1108 |
|
|
19 |
A" |
3013 |
2980 |
0.989 |
194 |
1109 |
|
|
20 |
A" |
1417 |
1455 |
1.027 |
194 |
1110 |
|
|
21 |
A" |
1023 |
1042 |
1.018 |
194 |
1111 |
|
|
22 |
A" |
993 |
973 |
0.980 |
194 |
1112 |
|
|
23 |
A" |
964 |
928 |
0.963 |
194 |
1113 |
|
|
24 |
A" |
770 |
780 |
1.013 |
194 |
1114 |
|
|
25 |
A" |
306 |
295 |
0.963 |
194 |
1115 |
|
|
26 |
A" |
201 |
173 |
0.860 |
194 |
1116 |
|
|
27 |
A" |
128 |
122 |
0.956 |
194 |
1117 |
C2H6O2S |
Dimethyl sulfone |
1 |
A1 |
3102 |
3018 |
0.973 |
195 |
1118 |
|
|
2 |
A1 |
2996 |
2936 |
0.980 |
195 |
1119 |
|
|
3 |
A1 |
1400 |
1451 |
1.037 |
195 |
1120 |
|
|
4 |
A1 |
1305 |
1337 |
1.025 |
195 |
1121 |
|
|
5 |
A1 |
1133 |
1121 |
0.989 |
195 |
1122 |
|
|
6 |
A1 |
981 |
1013 |
1.033 |
195 |
1123 |
|
|
7 |
A1 |
673 |
703 |
1.044 |
195 |
1124 |
|
|
8 |
A1 |
462 |
496 |
1.073 |
195 |
1125 |
|
|
9 |
A1 |
262 |
294 |
1.120 |
195 |
1126 |
|
|
10 |
A2 |
3109 |
3024 |
0.973 |
195 |
1127 |
|
|
11 |
A2 |
1382 |
1405 |
1.016 |
195 |
1128 |
|
|
12 |
A2 |
897 |
937 |
1.045 |
195 |
1129 |
|
|
13 |
A2 |
279 |
326 |
1.170 |
195 |
1130 |
|
|
14 |
A2 |
178 |
|
|
195 |
1131 |
|
|
15 |
B1 |
3113 |
3025 |
0.972 |
195 |
1132 |
|
|
16 |
B1 |
1403 |
1428 |
1.018 |
195 |
1133 |
|
|
17 |
B1 |
1329 |
1269 |
0.955 |
195 |
1134 |
|
|
18 |
B1 |
962 |
986 |
1.025 |
195 |
1135 |
|
|
19 |
B1 |
344 |
396 |
1.151 |
195 |
1136 |
|
|
20 |
B1 |
215 |
262 |
1.216 |
195 |
1137 |
|
|
21 |
B2 |
3101 |
3017 |
0.973 |
195 |
1138 |
|
|
22 |
B2 |
2994 |
2936 |
0.981 |
195 |
1139 |
|
|
23 |
B2 |
1387 |
1438 |
1.037 |
195 |
1140 |
|
|
24 |
B2 |
1284 |
1322 |
1.030 |
195 |
1141 |
|
|
25 |
B2 |
918 |
958 |
1.043 |
195 |
1142 |
|
|
26 |
B2 |
728 |
771 |
1.059 |
195 |
1143 |
|
|
27 |
B2 |
435 |
465 |
1.070 |
195 |
1144 |
CH3CHClCH3 |
Propane, 2-chloro- |
1 |
A' |
3071 |
3005 |
0.978 |
196 |
1145 |
|
|
2 |
A' |
3051 |
2955 |
0.969 |
196 |
1146 |
|
|
3 |
A' |
3010 |
2927 |
0.972 |
196 |
1147 |
|
|
4 |
A' |
2971 |
2878 |
0.969 |
196 |
1148 |
|
|
5 |
A' |
1451 |
1472 |
1.015 |
196 |
1149 |
|
|
6 |
A' |
1436 |
1454 |
1.013 |
196 |
1150 |
|
|
7 |
A' |
1363 |
1390 |
1.020 |
196 |
1151 |
|
|
8 |
A' |
1254 |
1270 |
1.013 |
196 |
1152 |
|
|
9 |
A' |
1153 |
1163 |
1.009 |
196 |
1153 |
|
|
10 |
A' |
1048 |
1065 |
1.016 |
196 |
1154 |
|
|
11 |
A' |
909 |
888 |
0.977 |
196 |
1155 |
|
|
12 |
A' |
629 |
633 |
1.006 |
196 |
1156 |
|
|
13 |
A' |
417 |
418 |
1.003 |
196 |
1157 |
|
|
14 |
A' |
335 |
336 |
1.002 |
196 |
1158 |
|
|
15 |
A' |
280 |
253 |
0.902 |
196 |
1159 |
|
|
16 |
A" |
3069 |
2997 |
0.977 |
196 |
1160 |
|
|
17 |
A" |
3044 |
2985 |
0.980 |
196 |
1161 |
|
|
18 |
A" |
2968 |
2947 |
0.993 |
196 |
1162 |
|
|
19 |
A" |
1423 |
1472 |
1.034 |
196 |
1163 |
|
|
20 |
A" |
1419 |
1454 |
1.025 |
196 |
1164 |
|
|
21 |
A" |
1355 |
1377 |
1.016 |
196 |
1165 |
|
|
22 |
A" |
1308 |
1334 |
1.020 |
196 |
1166 |
|
|
23 |
A" |
1150 |
1123 |
0.976 |
196 |
1167 |
|
|
24 |
A" |
926 |
972 |
1.049 |
196 |
1168 |
|
|
25 |
A" |
907 |
936 |
1.032 |
196 |
1169 |
|
|
26 |
A" |
318 |
317 |
0.998 |
196 |
1170 |
|
|
27 |
A" |
246 |
276 |
1.124 |
196 |
1171 |
C4H8 |
cyclobutane |
1 |
A1 |
3027 |
2951 |
0.975 |
197 |
1172 |
|
|
2 |
A1 |
2984 |
2862 |
0.959 |
197 |
1173 |
|
|
3 |
A1 |
1462 |
1468 |
1.004 |
197 |
1174 |
|
|
4 |
A1 |
1134 |
1153 |
1.017 |
197 |
1175 |
|
|
5 |
A1 |
1045 |
1004 |
0.961 |
197 |
1176 |
|
|
6 |
A1 |
212 |
199 |
0.938 |
197 |
1177 |
|
|
7 |
A2 |
1200 |
1260 |
1.050 |
197 |
1178 |
|
|
8 |
A2 |
940 |
941 |
1.001 |
197 |
1179 |
|
|
9 |
B1 |
1212 |
1231 |
1.016 |
197 |
1180 |
|
|
10 |
B1 |
1125 |
1142 |
1.015 |
197 |
1181 |
|
|
11 |
B1 |
954 |
928 |
0.973 |
197 |
1182 |
|
|
12 |
B2 |
3054 |
2973 |
0.974 |
197 |
1183 |
|
|
13 |
B2 |
2982 |
2934 |
0.984 |
197 |
1184 |
|
|
14 |
B2 |
1427 |
1440 |
1.009 |
197 |
1185 |
|
|
15 |
B2 |
883 |
883 |
1.000 |
197 |
1186 |
|
|
16 |
B2 |
604 |
625 |
1.035 |
197 |
1187 |
|
|
17 |
E |
3039 |
2959 |
0.974 |
197 |
1188 |
|
|
18 |
E |
2981 |
2862 |
0.960 |
197 |
1189 |
|
|
19 |
E |
1420 |
1441 |
1.015 |
197 |
1190 |
|
|
20 |
E |
1241 |
1252 |
1.009 |
197 |
1191 |
|
|
21 |
E |
1217 |
1217 |
1.000 |
197 |
1192 |
|
|
22 |
E |
921 |
893 |
0.970 |
197 |
1193 |
|
|
23 |
E |
741 |
746 |
1.006 |
197 |
1194 |
C6H6 |
Fulvene |
1 |
A1 |
3162 |
3088 |
0.977 |
198 |
1195 |
|
|
2 |
A1 |
3139 |
3051 |
0.972 |
198 |
1196 |
|
|
3 |
A1 |
3065 |
3008 |
0.981 |
198 |
1197 |
|
|
4 |
A1 |
1691 |
1632 |
0.965 |
198 |
1198 |
|
|
5 |
A1 |
1523 |
1486 |
0.976 |
198 |
1199 |
|
|
6 |
A1 |
1400 |
1449 |
1.035 |
198 |
1200 |
|
|
7 |
A1 |
1331 |
1342 |
1.008 |
198 |
1201 |
|
|
8 |
A1 |
1058 |
1082 |
1.023 |
198 |
1202 |
|
|
9 |
A1 |
1015 |
986 |
0.971 |
198 |
1203 |
|
|
10 |
A1 |
908 |
894 |
0.985 |
198 |
1204 |
|
|
11 |
A1 |
671 |
641 |
0.955 |
198 |
1205 |
|
|
12 |
A2 |
890 |
|
|
198 |
1206 |
|
|
13 |
A2 |
745 |
|
|
198 |
1207 |
|
|
14 |
A2 |
657 |
666 |
1.013 |
198 |
1208 |
|
|
15 |
A2 |
470 |
494 |
1.050 |
198 |
1209 |
|
|
16 |
B1 |
911 |
926 |
1.017 |
198 |
1210 |
|
|
17 |
B1 |
872 |
907 |
1.041 |
198 |
1211 |
|
|
18 |
B1 |
758 |
769 |
1.015 |
198 |
1212 |
|
|
19 |
B1 |
622 |
613 |
0.985 |
198 |
1213 |
|
|
20 |
B1 |
198 |
|
|
198 |
1214 |
|
|
21 |
B2 |
3158 |
|
|
198 |
1215 |
|
|
22 |
B2 |
3156 |
3104 |
0.984 |
198 |
1216 |
|
|
23 |
B2 |
3129 |
3075 |
0.983 |
198 |
1217 |
|
|
24 |
B2 |
1595 |
1550 |
0.972 |
198 |
1218 |
|
|
25 |
B2 |
1318 |
1314 |
0.997 |
198 |
1219 |
|
|
26 |
B2 |
1215 |
1232 |
1.014 |
198 |
1220 |
|
|
27 |
B2 |
1061 |
1077 |
1.015 |
198 |
1221 |
|
|
28 |
B2 |
939 |
952 |
1.014 |
198 |
1222 |
|
|
29 |
B2 |
795 |
795 |
1.000 |
198 |
1223 |
|
|
30 |
B2 |
328 |
350 |
1.067 |
198 |
1224 |
CH3CH2CH2CN |
Butanenitrile |
1 |
A' |
3059 |
2977 |
0.973 |
199 |
1225 |
|
|
2 |
A' |
2985 |
2895 |
0.970 |
199 |
1226 |
|
|
3 |
A' |
2967 |
2888 |
0.973 |
199 |
1227 |
|
|
4 |
A' |
2959 |
2883 |
0.974 |
199 |
1228 |
|
|
5 |
A' |
2325 |
2263 |
0.973 |
199 |
1229 |
|
|
6 |
A' |
1453 |
1472 |
1.013 |
199 |
1230 |
|
|
7 |
A' |
1436 |
1457 |
1.014 |
199 |
1231 |
|
|
8 |
A' |
1406 |
1438 |
1.023 |
199 |
1232 |
|
|
9 |
A' |
1367 |
1393 |
1.019 |
199 |
1233 |
|
|
10 |
A' |
1339 |
1346 |
1.005 |
199 |
1234 |
|
|
11 |
A' |
1256 |
1334 |
1.062 |
199 |
1235 |
|
|
12 |
A' |
1098 |
1100 |
1.002 |
199 |
1236 |
|
|
13 |
A' |
1070 |
1053 |
0.984 |
199 |
1237 |
|
|
14 |
A' |
984 |
920 |
0.935 |
199 |
1238 |
|
|
15 |
A' |
877 |
842 |
0.960 |
199 |
1239 |
|
|
16 |
A' |
539 |
551 |
1.023 |
199 |
1240 |
|
|
17 |
A' |
348 |
358 |
1.029 |
199 |
1241 |
|
|
18 |
A' |
162 |
|
|
199 |
1242 |
|
|
19 |
A" |
3045 |
2986 |
0.981 |
199 |
1243 |
|
|
20 |
A" |
3021 |
2964 |
0.981 |
199 |
1244 |
|
|
21 |
A" |
2993 |
2950 |
0.986 |
199 |
1245 |
|
|
22 |
A" |
1448 |
1469 |
1.014 |
199 |
1246 |
|
|
23 |
A" |
1289 |
1267 |
0.983 |
199 |
1247 |
|
|
24 |
A" |
1218 |
1234 |
1.013 |
199 |
1248 |
|
|
25 |
A" |
1089 |
1083 |
0.995 |
199 |
1249 |
|
|
26 |
A" |
846 |
871 |
1.030 |
199 |
1250 |
|
|
27 |
A" |
725 |
764 |
1.054 |
199 |
1251 |
|
|
28 |
A" |
396 |
370 |
0.935 |
199 |
1252 |
|
|
29 |
A" |
254 |
|
|
199 |
1253 |
|
|
30 |
A" |
99 |
|
|
199 |
1254 |
CH3SCH2CH3 |
Ethane, (methylthio)- |
1 |
A' |
3074 |
2991 |
0.973 |
200 |
1255 |
|
|
2 |
A' |
3055 |
2957 |
0.968 |
200 |
1256 |
|
|
3 |
A' |
2975 |
2920 |
0.982 |
200 |
1257 |
|
|
4 |
A' |
2961 |
2871 |
0.970 |
200 |
1258 |
|
|
5 |
A' |
2954 |
2830 |
0.958 |
200 |
1259 |
|
|
6 |
A' |
1451 |
1461 |
1.007 |
200 |
1260 |
|
|
7 |
A' |
1431 |
1435 |
1.003 |
200 |
1261 |
|
|
8 |
A' |
1424 |
1427 |
1.002 |
200 |
1262 |
|
|
9 |
A' |
1362 |
1377 |
1.011 |
200 |
1263 |
|
|
10 |
A' |
1319 |
1321 |
1.002 |
200 |
1264 |
|
|
11 |
A' |
1259 |
1262 |
1.003 |
200 |
1265 |
|
|
12 |
A' |
1085 |
1060 |
0.977 |
200 |
1266 |
|
|
13 |
A' |
1001 |
|
|
200 |
1267 |
|
|
14 |
A' |
940 |
968 |
1.030 |
200 |
1268 |
|
|
15 |
A' |
746 |
727 |
0.974 |
200 |
1269 |
|
|
16 |
A' |
691 |
654 |
0.946 |
200 |
1270 |
|
|
17 |
A' |
345 |
353 |
1.024 |
200 |
1271 |
|
|
18 |
A' |
186 |
227 |
1.219 |
200 |
1272 |
|
|
19 |
A" |
3054 |
2991 |
0.979 |
200 |
1273 |
|
|
20 |
A" |
3039 |
2957 |
0.973 |
200 |
1274 |
|
|
21 |
A" |
2998 |
2920 |
0.974 |
200 |
1275 |
|
|
22 |
A" |
1439 |
1449 |
1.007 |
200 |
1276 |
|
|
23 |
A" |
1411 |
1435 |
1.017 |
200 |
1277 |
|
|
24 |
A" |
1225 |
1239 |
1.011 |
200 |
1278 |
|
|
25 |
A" |
1025 |
|
|
200 |
1279 |
|
|
26 |
A" |
950 |
954 |
1.004 |
200 |
1280 |
|
|
27 |
A" |
776 |
757 |
0.976 |
200 |
1281 |
|
|
28 |
A" |
253 |
|
|
200 |
1282 |
|
|
29 |
A" |
172 |
|
|
200 |
1283 |
|
|
30 |
A" |
75 |
|
|
200 |
1284 |
C5H6S |
Thiophene, 3-methyl- |
1 |
A' |
3177 |
3111 |
0.979 |
201 |
1285 |
|
|
2 |
A' |
3165 |
3104 |
0.981 |
201 |
1286 |
|
|
3 |
A' |
3124 |
3062 |
0.980 |
201 |
1287 |
|
|
4 |
A' |
3059 |
2971 |
0.971 |
201 |
1288 |
|
|
5 |
A' |
2966 |
2923 |
0.985 |
201 |
1289 |
|
|
6 |
A' |
1580 |
1543 |
0.976 |
201 |
1290 |
|
|
7 |
A' |
1469 |
1447 |
0.985 |
201 |
1291 |
|
|
8 |
A' |
1436 |
1407 |
0.980 |
201 |
1292 |
|
|
9 |
A' |
1404 |
1385 |
0.987 |
201 |
1293 |
|
|
10 |
A' |
1356 |
1373 |
1.012 |
201 |
1294 |
|
|
11 |
A' |
1217 |
1234 |
1.014 |
201 |
1295 |
|
|
12 |
A' |
1151 |
1154 |
1.002 |
201 |
1296 |
|
|
13 |
A' |
1063 |
1080 |
1.016 |
201 |
1297 |
|
|
14 |
A' |
976 |
993 |
1.017 |
201 |
1298 |
|
|
15 |
A' |
940 |
931 |
0.990 |
201 |
1299 |
|
|
16 |
A' |
874 |
857 |
0.981 |
201 |
1300 |
|
|
17 |
A' |
842 |
830 |
0.986 |
201 |
1301 |
|
|
18 |
A' |
666 |
659 |
0.990 |
201 |
1302 |
|
|
19 |
A' |
547 |
542 |
0.991 |
201 |
1303 |
|
|
20 |
A' |
312 |
329 |
1.053 |
201 |
1304 |
|
|
21 |
A" |
3026 |
2945 |
0.973 |
201 |
1305 |
|
|
22 |
A" |
1429 |
1452 |
1.016 |
201 |
1306 |
|
|
23 |
A" |
1017 |
1036 |
1.019 |
201 |
1307 |
|
|
24 |
A" |
826 |
874 |
1.059 |
201 |
1308 |
|
|
25 |
A" |
726 |
762 |
1.049 |
201 |
1309 |
|
|
26 |
A" |
640 |
685 |
1.071 |
201 |
1310 |
|
|
27 |
A" |
588 |
594 |
1.010 |
201 |
1311 |
|
|
28 |
A" |
459 |
464 |
1.011 |
201 |
1312 |
|
|
29 |
A" |
229 |
238 |
1.041 |
201 |
1313 |
|
|
30 |
A" |
103 |
|
|
201 |
1314 |
CH2CHCHClCH3 |
1-Butene, 3-chloro- |
1 |
A |
3156 |
3088 |
0.978 |
202 |
1315 |
|
|
2 |
A |
3070 |
3017 |
0.983 |
202 |
1316 |
|
|
3 |
A |
3068 |
3011 |
0.981 |
202 |
1317 |
|
|
4 |
A |
3060 |
2990 |
0.977 |
202 |
1318 |
|
|
5 |
A |
3054 |
2974 |
0.974 |
202 |
1319 |
|
|
6 |
A |
3013 |
2967 |
0.985 |
202 |
1320 |
|
|
7 |
A |
2973 |
2927 |
0.985 |
202 |
1321 |
|
|
8 |
A |
1693 |
1645 |
0.972 |
202 |
1322 |
|
|
9 |
A |
1434 |
1452 |
1.013 |
202 |
1323 |
|
|
10 |
A |
1428 |
1447 |
1.014 |
202 |
1324 |
|
|
11 |
A |
1397 |
1424 |
1.020 |
202 |
1325 |
|
|
12 |
A |
1352 |
1375 |
1.017 |
202 |
1326 |
|
|
13 |
A |
1286 |
1297 |
1.009 |
202 |
1327 |
|
|
14 |
A |
1263 |
1283 |
1.016 |
202 |
1328 |
|
|
15 |
A |
1223 |
1233 |
1.008 |
202 |
1329 |
|
|
16 |
A |
1177 |
1174 |
0.997 |
202 |
1330 |
|
|
17 |
A |
1106 |
1090 |
0.986 |
202 |
1331 |
|
|
18 |
A |
1010 |
1025 |
1.015 |
202 |
1332 |
|
|
19 |
A |
980 |
988 |
1.008 |
202 |
1333 |
|
|
20 |
A |
949 |
966 |
1.018 |
202 |
1334 |
|
|
21 |
A |
901 |
931 |
1.033 |
202 |
1335 |
|
|
22 |
A |
870 |
864 |
0.993 |
202 |
1336 |
|
|
23 |
A |
707 |
708 |
1.001 |
202 |
1337 |
|
|
24 |
A |
630 |
625 |
0.993 |
202 |
1338 |
|
|
25 |
A |
457 |
456 |
0.998 |
202 |
1339 |
|
|
26 |
A |
314 |
319 |
1.016 |
202 |
1340 |
|
|
27 |
A |
297 |
305 |
1.026 |
202 |
1341 |
|
|
28 |
A |
277 |
283 |
1.020 |
202 |
1342 |
|
|
29 |
A |
256 |
245 |
0.958 |
202 |
1343 |
|
|
30 |
A |
103 |
92 |
0.894 |
202 |
1344 |
C5H8 |
1,2-Butadiene, 3-methyl- |
1 |
A1 |
3070 |
2987 |
0.973 |
203 |
1345 |
|
|
2 |
A1 |
3033 |
2941 |
0.970 |
203 |
1346 |
|
|
3 |
A1 |
2951 |
2916 |
0.988 |
203 |
1347 |
|
|
4 |
A1 |
2058 |
1996 |
0.970 |
203 |
1348 |
|
|
5 |
A1 |
1475 |
1470 |
0.997 |
203 |
1349 |
|
|
6 |
A1 |
1412 |
1438 |
1.019 |
203 |
1350 |
|
|
7 |
A1 |
1355 |
1369 |
1.011 |
203 |
1351 |
|
|
8 |
A1 |
1284 |
1286 |
1.001 |
203 |
1352 |
|
|
9 |
A1 |
996 |
973 |
0.977 |
203 |
1353 |
|
|
10 |
A1 |
752 |
726 |
0.965 |
203 |
1354 |
|
|
11 |
A1 |
331 |
349 |
1.056 |
203 |
1355 |
|
|
12 |
A2 |
3006 |
2941 |
0.978 |
203 |
1356 |
|
|
13 |
A2 |
1413 |
1470 |
1.040 |
203 |
1357 |
|
|
14 |
A2 |
963 |
985 |
1.023 |
203 |
1358 |
|
|
15 |
A2 |
599 |
617 |
1.029 |
203 |
1359 |
|
|
17 |
B1 |
3103 |
3051 |
0.983 |
203 |
1360 |
|
|
18 |
B1 |
3005 |
2941 |
0.979 |
203 |
1361 |
|
|
19 |
B1 |
1434 |
1470 |
1.025 |
203 |
1362 |
|
|
20 |
B1 |
1053 |
1068 |
1.015 |
203 |
1363 |
|
|
21 |
B1 |
982 |
1004 |
1.023 |
203 |
1364 |
|
|
22 |
B1 |
449 |
443 |
0.987 |
203 |
1365 |
|
|
23 |
B1 |
255 |
187 |
0.734 |
203 |
1366 |
|
|
25 |
B2 |
3070 |
2941 |
0.958 |
203 |
1367 |
|
|
26 |
B2 |
2948 |
2916 |
0.989 |
203 |
1368 |
|
|
27 |
B2 |
1422 |
1470 |
1.034 |
203 |
1369 |
|
|
28 |
B2 |
1341 |
1369 |
1.021 |
203 |
1370 |
|
|
29 |
B2 |
1221 |
1191 |
0.975 |
203 |
1371 |
|
|
30 |
B2 |
936 |
968 |
1.034 |
203 |
1372 |
|
|
31 |
B2 |
820 |
848 |
1.035 |
203 |
1373 |
|
|
32 |
B2 |
592 |
554 |
0.936 |
203 |
1374 |
|
|
33 |
B2 |
175 |
187 |
1.070 |
203 |
1375 |
CH3CH2CH2CH3 |
Butane |
|
Ag |
424 |
1442 |
3.398 |
204 |
1376 |
|
|
|
Ag |
844 |
1151 |
1.364 |
204 |
1377 |
|
|
|
Au |
1246 |
1257 |
1.009 |
204 |
1378 |
|
|
|
Bg |
1443 |
1300 |
0.901 |
204 |
1379 |
|
|
|
Bu |
2950 |
2870 |
0.973 |
204 |
1380 |
|
|
|
Bu |
2962 |
2853 |
0.963 |
204 |
1381 |
|
|
|
Bu |
3047 |
271 |
0.089 |
204 |
1382 |
C6H8 |
(E)-hexa-1,3,5-triene |
1 |
Ag |
3161 |
3085 |
0.976 |
205 |
1383 |
|
|
2 |
Ag |
3065 |
3054 |
0.996 |
205 |
1384 |
|
|
3 |
Ag |
3055 |
3054 |
1.000 |
205 |
1385 |
|
|
4 |
Ag |
3041 |
2989 |
0.983 |
205 |
1386 |
|
|
5 |
Ag |
1677 |
1627 |
0.970 |
205 |
1387 |
|
|
6 |
Ag |
1616 |
1579 |
0.977 |
205 |
1388 |
|
|
7 |
Ag |
1380 |
1400 |
1.014 |
205 |
1389 |
|
|
8 |
Ag |
1277 |
1288 |
1.008 |
205 |
1390 |
|
|
9 |
Ag |
1271 |
1220 |
0.960 |
205 |
1391 |
|
|
10 |
Ag |
1199 |
1192 |
0.994 |
205 |
1392 |
|
|
11 |
Ag |
923 |
934 |
1.012 |
205 |
1393 |
|
|
12 |
Ag |
444 |
444 |
1.001 |
205 |
1394 |
|
|
13 |
Ag |
341 |
355 |
1.041 |
205 |
1395 |
|
|
14 |
Au |
1010 |
1013 |
1.003 |
205 |
1396 |
|
|
15 |
Au |
914 |
941 |
1.030 |
205 |
1397 |
|
|
16 |
Au |
867 |
901 |
1.039 |
205 |
1398 |
|
|
17 |
Au |
688 |
683 |
0.993 |
205 |
1399 |
|
|
18 |
Au |
255 |
|
|
205 |
1400 |
|
|
19 |
Au |
99 |
90 |
0.908 |
205 |
1401 |
|
|
20 |
Bg |
976 |
988 |
1.013 |
205 |
1402 |
|
|
21 |
Bg |
885 |
928 |
1.049 |
205 |
1403 |
|
|
22 |
Bg |
858 |
872 |
1.016 |
205 |
1404 |
|
|
23 |
Bg |
596 |
|
|
205 |
1405 |
|
|
24 |
Bg |
231 |
217 |
0.938 |
205 |
1406 |
|
|
25 |
Bu |
3161 |
3099 |
0.981 |
205 |
1407 |
|
|
26 |
Bu |
3065 |
3045 |
0.993 |
205 |
1408 |
|
|
27 |
Bu |
3057 |
3019 |
0.988 |
205 |
1409 |
|
|
28 |
Bu |
3044 |
2953 |
0.970 |
205 |
1410 |
|
|
29 |
Bu |
1672 |
1629 |
0.974 |
205 |
1411 |
|
|
30 |
Bu |
1412 |
1432 |
1.014 |
205 |
1412 |
|
|
31 |
Bu |
1278 |
1295 |
1.013 |
205 |
1413 |
|
|
32 |
Bu |
1233 |
1255 |
1.018 |
205 |
1414 |
|
|
33 |
Bu |
1160 |
1186 |
1.022 |
205 |
1415 |
|
|
34 |
Bu |
959 |
963 |
1.004 |
205 |
1416 |
|
|
35 |
Bu |
530 |
590 |
1.112 |
205 |
1417 |
|
|
36 |
Bu |
142 |
170 |
1.198 |
205 |
1418 |
C4H9N |
Cyclobutylamine |
1 |
A' |
3405 |
3345 |
0.982 |
206 |
1419 |
|
|
2 |
A' |
3074 |
2975 |
0.968 |
206 |
1420 |
|
|
3 |
A' |
3037 |
2950 |
0.971 |
206 |
1421 |
|
|
4 |
A' |
3009 |
2918 |
0.970 |
206 |
1422 |
|
|
5 |
A' |
2985 |
2905 |
0.973 |
206 |
1423 |
|
|
6 |
A' |
2877 |
2887 |
1.004 |
206 |
1424 |
|
|
7 |
A' |
1633 |
1614 |
0.989 |
206 |
1425 |
|
|
8 |
A' |
1440 |
1467 |
1.019 |
206 |
1426 |
|
|
9 |
A' |
1409 |
1443 |
1.024 |
206 |
1427 |
|
|
10 |
A' |
1339 |
1390 |
1.038 |
206 |
1428 |
|
|
11 |
A' |
1242 |
1291 |
1.039 |
206 |
1429 |
|
|
12 |
A' |
1210 |
1237 |
1.022 |
206 |
1430 |
|
|
13 |
A' |
1144 |
1137 |
0.994 |
206 |
1431 |
|
|
14 |
A' |
1078 |
1120 |
1.039 |
206 |
1432 |
|
|
15 |
A' |
968 |
1050 |
1.085 |
206 |
1433 |
|
|
16 |
A' |
890 |
965 |
1.084 |
206 |
1434 |
|
|
17 |
A' |
857 |
788 |
0.919 |
206 |
1435 |
|
|
18 |
A' |
785 |
752 |
0.958 |
206 |
1436 |
|
|
19 |
A' |
638 |
606 |
0.949 |
206 |
1437 |
|
|
20 |
A' |
397 |
448 |
1.128 |
206 |
1438 |
|
|
21 |
A' |
180 |
174 |
0.965 |
206 |
1439 |
|
|
22 |
A" |
3491 |
3411 |
0.977 |
206 |
1440 |
|
|
23 |
A" |
3041 |
2970 |
0.977 |
206 |
1441 |
|
|
24 |
A" |
2981 |
2957 |
0.992 |
206 |
1442 |
|
|
25 |
A" |
1403 |
1452 |
1.035 |
206 |
1443 |
|
|
26 |
A" |
1312 |
1213 |
0.924 |
206 |
1444 |
|
|
27 |
A" |
1234 |
1185 |
0.961 |
206 |
1445 |
|
|
28 |
A" |
1211 |
1168 |
0.964 |
206 |
1446 |
|
|
29 |
A" |
1189 |
1036 |
0.871 |
206 |
1447 |
|
|
30 |
A" |
1117 |
|
|
206 |
1448 |
|
|
31 |
A" |
1007 |
925 |
0.918 |
206 |
1449 |
|
|
32 |
A" |
949 |
912 |
0.961 |
206 |
1450 |
|
|
33 |
A" |
919 |
883 |
0.961 |
206 |
1451 |
|
|
34 |
A" |
758 |
788 |
1.039 |
206 |
1452 |
|
|
35 |
A" |
392 |
354 |
0.904 |
206 |
1453 |
|
|
36 |
A" |
276 |
240 |
0.871 |
206 |
1454 |
CH3C(SCH3)HCH3 |
Propane, 2-(methylthio)- |
1 |
A |
3074 |
2971 |
0.967 |
207 |
1455 |
|
|
2 |
A |
3055 |
2971 |
0.972 |
207 |
1456 |
|
|
3 |
A |
3050 |
2971 |
0.974 |
207 |
1457 |
|
|
4 |
A |
3044 |
2971 |
0.976 |
207 |
1458 |
|
|
5 |
A |
3041 |
2971 |
0.977 |
207 |
1459 |
|
|
6 |
A |
3033 |
2971 |
0.980 |
207 |
1460 |
|
|
7 |
A |
2966 |
2918 |
0.984 |
207 |
1461 |
|
|
8 |
A |
2963 |
2899 |
0.979 |
207 |
1462 |
|
|
9 |
A |
2959 |
2867 |
0.969 |
207 |
1463 |
|
|
10 |
A |
2949 |
2867 |
0.972 |
207 |
1464 |
|
|
11 |
A |
1453 |
1448 |
0.996 |
207 |
1465 |
|
|
12 |
A |
1442 |
1448 |
1.004 |
207 |
1466 |
|
|
13 |
A |
1432 |
1448 |
1.011 |
207 |
1467 |
|
|
14 |
A |
1429 |
1448 |
1.013 |
207 |
1468 |
|
|
15 |
A |
1418 |
1448 |
1.021 |
207 |
1469 |
|
|
16 |
A |
1407 |
1448 |
1.029 |
207 |
1470 |
|
|
17 |
A |
1359 |
1386 |
1.020 |
207 |
1471 |
|
|
18 |
A |
1346 |
1364 |
1.013 |
207 |
1472 |
|
|
19 |
A |
1313 |
1339 |
1.020 |
207 |
1473 |
|
|
20 |
A |
1296 |
1315 |
1.014 |
207 |
1474 |
|
|
21 |
A |
1235 |
1244 |
1.007 |
207 |
1475 |
|
|
22 |
A |
1150 |
1154 |
1.003 |
207 |
1476 |
|
|
23 |
A |
1137 |
1110 |
0.977 |
207 |
1477 |
|
|
24 |
A |
1045 |
1058 |
1.012 |
207 |
1478 |
|
|
25 |
A |
954 |
|
|
207 |
1479 |
|
|
26 |
A |
943 |
954 |
1.011 |
207 |
1480 |
|
|
27 |
A |
933 |
|
|
207 |
1481 |
|
|
28 |
A |
905 |
924 |
1.021 |
207 |
1482 |
|
|
29 |
A |
897 |
882 |
0.983 |
207 |
1483 |
|
|
30 |
A |
741 |
724 |
0.976 |
207 |
1484 |
|
|
31 |
A |
643 |
632 |
0.983 |
207 |
1485 |
|
|
32 |
A |
414 |
427 |
1.032 |
207 |
1486 |
|
|
33 |
A |
341 |
336 |
0.984 |
207 |
1487 |
|
|
34 |
A |
326 |
|
|
207 |
1488 |
|
|
35 |
A |
263 |
|
|
207 |
1489 |
|
|
36 |
A |
240 |
|
|
207 |
1490 |
|
|
37 |
A |
215 |
215 |
0.998 |
207 |
1491 |
|
|
38 |
A |
151 |
|
|
207 |
1492 |
|
|
39 |
A |
73 |
|
|
207 |
1493 |
C5H12 |
Propane, 2,2-dimethyl- |
1 |
A1 |
2958 |
2909 |
0.983 |
208 |
1494 |
|
|
2 |
A1 |
1379 |
1381 |
1.001 |
208 |
1495 |
|
|
3 |
A1 |
756 |
733 |
0.970 |
208 |
1496 |
|
|
4 |
A2 |
267 |
198 |
0.742 |
208 |
1497 |
|
|
5 |
E |
3035 |
2955 |
0.974 |
208 |
1498 |
|
|
6 |
E |
1434 |
1451 |
1.012 |
208 |
1499 |
|
|
7 |
E |
1056 |
999 |
0.946 |
208 |
1500 |
|
|
8 |
E |
338 |
335 |
0.990 |
208 |
1501 |
|
|
9 |
T1 |
3034 |
2975 |
0.980 |
208 |
1502 |
|
|
10 |
T1 |
1423 |
1461 |
1.026 |
208 |
1503 |
|
|
11 |
T1 |
931 |
932 |
1.001 |
208 |
1504 |
|
|
12 |
T1 |
339 |
203 |
0.599 |
208 |
1505 |
|
|
13 |
T2 |
3036 |
2959 |
0.975 |
208 |
1506 |
|
|
14 |
T2 |
2953 |
2876 |
0.974 |
208 |
1507 |
|
|
15 |
T2 |
1472 |
1475 |
1.002 |
208 |
1508 |
|
|
16 |
T2 |
1340 |
1372 |
1.024 |
208 |
1509 |
|
|
17 |
T2 |
1262 |
1256 |
0.995 |
208 |
1510 |
|
|
18 |
T2 |
944 |
925 |
0.980 |
208 |
1511 |
|
|
19 |
T2 |
417 |
418 |
1.003 |
208 |
1512 |