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List of which calculations are completed at CCSD(T) /cc-pV(T+d)Z

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count Species Name State Conformation
1 D Deuterium atom 1SKh
2 H Hydrogen atom 1SKh
3 H+ Hydrogen atom cation  Kh
4 D2 Deuterium diatomic 1ΣgD∞h
5 H2 Hydrogen diatomic 1ΣgD∞h
6 H2- hydrogen diatomic anion 2Σu+D∞h
7 HD Deuterium hydride 1ΣgD∞h
8 He Helium atom 1SKh
9 He2+ helium diatomic cation 2ΣuD∞h
10 Li Lithium atom 2SKh
11 Na Sodium atom 2SKh
12 LiH Lithium Hydride 1ΣC∞v
13 LiH- lithium hydride anion 2ΣC∞v
14 LiH+ lithium hydride cation 2ΣC∞v
15 NaH sodium hydride 1ΣC∞v
16 NaH- sodium hydride anion 2ΣC∞v
17 NaH+ sodium hydride cation 2ΣC∞v
18 Be Beryllium atom 1SKh
19 Mg Magnesium atom 1SKh
20 BeH beryllium monohydride 2ΣC∞v
21 BeH- berylium monohydride anion 1ΣC∞v
22 BeH+ beryllium monohydride cation 1ΣC∞v
23 MgH magnesium monohydride 2ΣC∞v
24 MgH- magnesium monohydride anion 1ΣC∞v
25 MgH+ magnesium monohydride cation 1ΣC∞v
26 BeH2 beryllium dihydride 1ΣgD∞h
27 MgH2 magnesium dihydride 1ΣgD∞h
28 B Boron atom 2PKh
29 Al Aluminum atom 2PKh
30 BH Boron monohydride 1ΣC∞v
31 BH- boron monohydride anion 2ΠC∞v
32 BH+ boron monohydride cation 2ΣC∞v
33 AlH aluminum monohydride 1ΣC∞v
34 AlH- aluminum monohydride anion 2ΠC∞v
35 AlH+ aluminum monohydride cation 2ΣC∞v
36 BH2 boron dihydride 2A1C2v
37 AlH2 aluminum dihydride 2A1C2v
38 BH3 boron trihydride 1A1'D3h
39 AlH3 aluminum trihydride 1A1'D3h
40 AlH4- Aluminum tetrahydride anion 1A1Td
41 C Carbon atom 3P0Kh
42 Si Silicon atom 3PKh
43 CH Methylidyne 2Π1/2C∞v
44 CH- methylidyne anion 3ΣC∞v
45 CH+ Methylidyne cation 1ΣC∞v
46 SiH Silylidyne 2ΠC∞v
47 SiH- silicon monohydride anion 3ΣC∞v
48 SiH+ silicon monohydride cation 1ΣC∞v
49 CH2 Methylene 3B1C2v
50 CH2 Methylene 1A1C2v
51 CH2- methylene anion 2B1C2v
52 CH2+ methylene cation 2A1C2v
53 SiH2 silicon dihydride 1A1C2v
54 SiH2 silicon dihydride 3B1C2v
55 CH3 Methyl radical 2A1D3h
56 CH3- methyl anion 1A1C3v
57 CH3+ methyl cation 1A1'D3h
58 SiH3 Silyl radical 2A1C3v
59 SiH3+ Silyl cation 1A1'D3h
60 CH4 Methane 1A1Td
61 SiH4 Silane 1A1Td
62 P Phosphorus atom 4SKh
63 NH Imidogen 3Σ-C∞v
64 NH Imidogen 1Σ+C∞v
65 NH- Imidogen anion 2ΠC∞v
66 NH+ imidogen cation 2ΠC∞v
67 PH phosphorus monohydride 3Σ-C∞v
68 PH phosphorus monohydride 1ΔC∞v
69 PH- phosphorus monohydride anion 2ΠC∞v
70 PH+ phosphorus monohydride cation 2ΠC∞v
71 ND2 Amidogen-d2 2B1C2v
72 NH2 Amino radical 2B1C2v
73 NH2- amino anion 1A1C2v
74 PH2 Phosphino radical 2B1C2v
75 ND3 Ammonia-d3 1A1C3v
76 NH3 Ammonia 1A1C3v
77 PH3 Phosphine 1A1C3v
78 PH4+ phosphonium cation   
79 O Oxygen atom 3SKh
80 S Sulfur atom 3PKh
81 DO Hydroxyl-d 2ΠC∞v
82 OH Hydroxyl radical 2ΠC∞v
83 OH- hydroxide anion 1ΣC∞v
84 OH+ hydoxyl cation 3ΣC∞v
85 OH+ hydoxyl cation 1ΣC∞v
86 DS Mercapto-d 2ΠC∞v
87 HS Mercapto radical 2ΠC∞v
88 HS- mercapto anion 1ΣC∞v
89 HS+ sulfur monohydride cation 3ΣC∞v
90 D2O Deuterium oxide 1A1C2v
91 H2O Water 1A1C2v
92 H2O- water anion 2A1C2v
93 H2O+ water cation 2B1C2v
94 HDO Water-d1 1A1C2v
95 D2S Hydrogen sulfide-d2 1A1C2v
96 H2S Hydrogen sulfide 1A1C2v
97 H2S+ Hydrogen sulfide cation 2B1C2v
98 H3O+ hydronium cation 1A1C3v
99 H3S+ Sulfonium cation 1A1C3v
100 F Fluorine atom 2PKh
101 Cl Chlorine atom 2PKh
102 DF Hydrofluoric acid-d 1ΣC∞v
103 HF Hydrogen fluoride 1ΣC∞v
104 HF- hydrogen fluoride anion 2ΣC∞v
105 HF+ hydrogen fluoride cation 2ΠC∞v
106 HCl Hydrogen chloride 1ΣC∞v
107 HCl- hydrogen chloride anion 2ΣC∞v
108 HCl+ hydrogen chloride cation 2ΠC∞v
109 H2Cl+ dihydrogen monochloride cation 1A1C2v
110 Ne Neon atom 1SKh
111 NeH+ neon hydrogen cation 1ΣC∞v
112 Li2 Lithium diatomic 1ΣgD∞v
113 Li2- lithium diatomic anion 2ΣuD∞h
114 NaLi lithium sodium 1ΣC∞v
115 NaLi- lithium sodium anion 2ΣC∞v
116 NaLi+ lithium sodium cation 2ΣC∞v
117 Na2 Sodium diatomic 1ΣgD∞h
118 Na2- sodium diatomic anion 2ΣuD∞h
119 Na2+ sodium diatomic cation 2ΣgD∞h
120 Be2- Beryllium diatomic anion 2ΠuD∞h
121 Be2+ Beryllium diatomic cation 2ΣuD∞h
122 Mg2 Magnesium diatomic 1ΣgD∞h
123 Mg2- magnesium diatomic anion 2ΠUD∞h
124 Mg2+ magnesium diatomic cation 2ΣuD∞h
125 B2 Boron diatomic 3ΣgD∞h
126 B2 Boron diatomic 1ΣgD∞h
127 B2 Boron diatomic 5ΣuD∞h
128 B2- Boron diatomic anion 4ΣgD∞h
129 BAl Boron Aluminum 3ΣC∞v
130 Al2 Aluminum diatomic 3ΣgD∞h
131 Al2- aluminum diatomic anion 4ΣgD∞h
132 Al2+ aluminum diatomic cation 2ΣgD∞h
133 B2H6 Diborane 1AgD2h
134 BC- boron monocarbide anion 1Σg+C∞v
135 BC+ boron monocarbide cation 3ΣC∞v
136 BC+ boron monocarbide cation 1ΣC∞v
137 AlC Aluminum carbide 4ΣC∞v
138 C2 Carbon diatomic 1Σg+D∞h
139 C2 Carbon diatomic 3ΠuD∞h
140 C2- carbon diatomic anion 2ΣgD∞h
141 C2+ carbon diatomic cation 2ΠD∞h
142 SiC silicon monocarbide 3ΣC∞v
143 SiC silicon monocarbide 1ΣC∞v
144 Si2 Silicon diatomic 3ΣgD∞h
145 C2H Ethynyl radical 2ΣC∞v
146 C2H2 Acetylene 1ΣgD∞h
147 C2H2+ acetylene cation 2ΠuD∞h
148 CCH2 vinylidene 1A1C2v
149 C2H3 vinyl 2A'Cs
150 C2H4 Ethylene 1AgD2h
151 C2H5 Ethyl radical 2A'Cs
152 C2H6 Ethane 1A1gD3d
153 Si2H6 disilane 1EuD3d
154 BeN- Beryllium mononitride anion 1ΣC∞v
155 BN- boron nitride anion 2ΣC∞v
156 BN boron nitride 3ΠC∞v
157 BN boron nitride 1ΣC∞v
158 BN+ boron nitride cation 2ΠC∞v
159 AlN Aluminum nitride 3ΠiC∞v
160 CN Cyano radical 2ΣC∞v
161 CN- cyanide anion 1ΣC∞v
162 CN+ Cyano cation 1ΣC∞v
163 CP Carbon monophosphide 2ΣC∞v
164 SiN Silicon nitride 2ΣC∞v
165 SiP Silicon monophosphide 2ΠC∞v
166 N2 Nitrogen diatomic 1ΣgD∞h
167 N2- nitrogen diatomic anion 2ΠgD∞h
168 N2+ diatomic nitrogen cation 2ΣgD∞h
169 PN Phosphorus mononitride 1ΣC∞v
170 P2 Phosphorus diatomic 1ΣgD∞h
171 HNC hydrogen isocyanide 1ΣC∞v
172 HCN Hydrogen cyanide 1ΣC∞v
173 HCN+ hydrogen cyanide cation 2ΠC∞v
174 N2H2 (E)-diazene 1AgC2h
175 CH2PH Phosphaethene 1A'Cs
176 CH2NH2+ methyleneamine cation 1A1C2v
177 BH3PH3 borane phosphine   
178 LiO lithium oxide 2ΣC∞v
179 LiO- lithium oxide anion 1ΣC∞v
180 LiO+ lithium oxide cation 3ΣC∞v
181 LiO+ lithium oxide cation 1ΣC∞v
182 LiS Lithium monosulfide 2ΠC∞v
183 NaO sodium monoxide 2ΣC∞v
184 NaO- sodium oxide anion 1ΣC∞v
185 NaO+ sodium oxide cation 3ΣC∞v
186 BeO beryllium oxide 1ΣC∞v
187 BeO- Beryllium monoxide anion 2ΣC∞v
188 BeO+ Beryllium monoxide cation 2ΠC∞v
189 BeS beryllium sulfide 1ΣC∞v
190 MgO magnesium oxide 1Σ+C∞v
191 MgO- magnesium oxide anion 2ΣC∞v
192 MgO+ magnesium oxide cation 2ΠC∞v
193 MgS magnesium sulfide 1ΣC∞v
194 CaS Calcium sulfide 1ΣC∞v
195 BO boron monoxide 2ΣC∞v
196 BO- boron monoxide anion 1ΣC∞v
197 AlO Aluminum monoxide 2ΣC∞v
198 BS boron sulfide 2ΣC∞v
199 AlS Aluminum sulfide 2ΣC∞v
200 BO+ boron monoxide cation 1ΣC∞v
201 CO Carbon monoxide 1ΣC∞v
202 CO- carbon monoxide anion 2ΠC∞v
203 CO+ carbon monoxide cation 2ΣC∞v
204 CS carbon monosulfide 1ΣC∞v
205 SiO Silicon monoxide 1ΣC∞v
206 SiS silicon monosulfide 1ΣC∞v
207 GeO Germanium monoxide 1ΣC∞v
208 SiSe Silicon Monoselenide   
209 NO Nitric oxide 2ΠC∞v
210 NO- nitric oxide anion 3ΣC∞v
211 NO- nitric oxide anion 1ΔC∞v
212 NO+ nitric oxide cation 1ΣC∞v
213 NS Mononitrogen monosulfide 2ΠC∞v
214 PO Phosphorus monoxide 2ΠC∞v
215 PS phosphorus sulfide 2ΣC∞v
216 O2 Oxygen diatomic 3ΣgD∞h
217 O2- oxygen diatomic anion 2ΠD∞h
218 O2+ diatomic oxygen cation 2ΠgD∞h
219 SO Sulfur monoxide 3ΣC∞v
220 SO Sulfur monoxide 1ΣC∞v
221 SO+ sulfur monoxide cation 2ΠC∞v
222 S2 Sulfur diatomic 3ΣgD∞h
223 S2+ sulfur diatomic cation 2ΠD∞h
224 Se2 Selenium diatomic 3ΣgD∞h
225 LiOH lithium hydroxide 1ΣC∞v
226 MgOH magnesium hydroxide 2A'Cs
227 HCO Formyl radical 2A'Cs
228 HNO Nitrosyl hydride 1A'Cs
229 HO2 Hydroperoxy radical 2A"Cs
230 HSO+ Sulfur Monoxide, S-protonated   
231 SOH Sulfur Hydroxide   
232 SOH+ Sulfur Monoxide, protonated   
233 H2CO Formaldehyde 1A1C2v
234 H2CO+ formaldehyde cation 2B2C2v
235 H2CS Thioformaldehyde 1A1C2v
236 H2CSe Selenoformaldehyde   
237 H2O2 Hydrogen peroxide 1AC2
238 H2S2 Disulfane 1AC2
239 H2S2+ hydrogen disulfide cation 2BgC2h
240 CH2OH+ hydroxymethyl cation 1A'Cs
241 H2CSH+ Thioformaldehyde, protonated 1A'Cs
242 NH2OH hydroxylamine 1A'Cs
243 H2POH Phosphinous acid 1A1'CS trans
244 H2POH Phosphinous acid 1A1'CS cis
245 H3PO Phosphine oxide 1A1C3v
246 CH3OH Methyl alcohol 1A'Cs
247 CH3SH Methanethiol 1A'Cs
248 CH3SH2+ protonated methylsulfide 1A'Cs
249 LiF lithium fluoride 1ΣC∞v
250 LiCl lithium chloride 1ΣC∞v
251 NaF sodium fluoride 1ΣC∞v
252 NaF- sodium fluoride anion 2ΣC∞v
253 NaF+ sodium fluoride cation 2ΣC∞v
254 NaCl Sodium Chloride 1ΣC∞v
255 LiF- lithium fluoride anion 2ΣC∞v
256 LiF+ lithium fluoride cation 2ΠC∞v
257 BeF Beryllium monofluoride 2ΣC∞v
258 BeF- Beryllium monofluoride anion 1ΣC∞v
259 BeF+ Beryllium monofluoride cation 1ΣC∞v
260 MgF Magnesium monofluoride 2ΣC∞v
261 MgF- magnesium fluoride anion 1ΣC∞v
262 MgF+ magnesium fluoride cation 1ΣC∞v
263 BF Boron monofluoride 1ΣC∞v
264 BF- Boron monofluoride anion 2ΠC∞v
265 BF+ Boron monofluoride cation 2ΣC∞v
266 AlF Aluminum monofluoride 1Σ+C∞v
267 BCl boron monochloride 1ΣC∞v
268 AlCl Aluminum monochloride 1ΣC∞v
269 CF Fluoromethylidyne 2ΠC∞v
270 CF- carbon monofluoride anion 3ΣC∞v
271 CF- carbon monofluoride anion 1ΣC∞v
272 CF+ carbon monofluoride cation 1ΣC∞v
273 SiF silicon monofluoride 2ΠC∞v
274 SiF+ silicon monofluoride cation 1ΣC∞v
275 SiCl Clorosilylidyne 2ΠC∞v
276 NF nitrogen fluoride 3ΣC∞v
277 NF nitrogen fluoride 1ΣC∞v
278 NF- nitrogen monofluorine anion 2ΠC∞v
279 NF+ nitrogen monofluoirde cation 2ΠC∞v
280 NCl nitrogen monochloride 3ΣC∞v
281 PF phosphorus monofluoride 3ΣC∞v
282 FO Oxygen monofluoride 2ΠC∞v
283 FO- flourine oxide anion 1ΣC∞v
284 FO+ fluorine monoxide cation 3ΣC∞v
285 ClO Monochlorine monoxide 2ΠC∞v
286 SF Monosulfur monofluoride 2ΠC∞v
287 SF+ sulfur monofluoride cation 3ΣC∞v
288 SCl sulfur monochloride 2ΠC∞v
289 SCl+ sulfur monochloride cation 3ΣgC∞v
290 SBr Sulfur monobromide radical   
291 F2 Fluorine diatomic 1ΣgD∞h
292 F2- flourine diatomic anion 2ΣuD∞h
293 F2+ flourine diatomic cation 2ΠgD∞h
294 ClF Chlorine monofluoride 1Σ+C∞v
295 Cl2 Chlorine diatomic 1ΣgD∞h
296 Cl2- chlorine diatomic anion 2ΣuD∞h
297 Cl2+ chlorine diatomic cation 2ΠgD∞h
298 HOF Hypofluorous acid 1A'Cs
299 HOCl hypochlorous acid 1A'Cs
300 CH3Cl Methyl chloride 1A1C3v
301 SiH3Cl chlorosilane 1A1C1
302 C3 carbon trimer 1ΣgD∞h
303 CH2CCH2 allene 1A1D2d
304 Si3H8 trisilane   
305 HN3 hydrogen azide 1A'Cs
306 Li2O dilithium oxide 1ΣgD∞h
307 Li2S dilithium sulfide 1ΣGD∞h
308 Li2S dilithium sulfide 1A1C2v
309 N2O Nitrous oxide 1ΣC∞v
310 NNS Nitrogen sulfide 1ΣC∞v
311 CO2 Carbon dioxide 1ΣgD∞h
312 OCS Carbonyl sulfide 1ΣC∞v
313 CS2 Carbon disulfide 1ΣgD∞h
314 SiS2 Silicon disulfide 1ΣGD∞h
315 NO2 Nitrogen dioxide 2A1C2v
316 NSO sulfinyl amidogen   
317 SNO Nitrogen oxide sulfide   
318 O3 Ozone 1A1Cs
319 SO2 Sulfur dioxide 1A1C2v
320 S3 Sulfur trimer 1A1C2v
321 S3 Sulfur trimer   
322 S3+ Sulfur trimer cation 2B2C2v
323 HCCO ketenyl radical 2A"Cs
324 HCNO fulminic acid 1ΣC∞v
325 HOCO Hydrocarboxyl radical 1A'cis
326 HOCO Hydrocarboxyl radical 1A'trans
327 HCCOH ethynol 1A'Cs
328 CH2CS Thioketene   
329 HCOOH Formic acid 1A'Cs
330 HSSSH trisulfane 1AC2
331 HSSSH trisulfane 1A'Cs
332 CH3CO Acetyl radical 2A'Cs
333 CH3OO methylperoxy radical 2A"Cs
334 C2H4S Thiirane 1A1C2v
335 CH3CHS Thioacetaldehyde 1A'C1
336 CH3SSH Hydrogen methyl disulfide   
337 CH3CH2SH ethanethiol 1A'Cs
338 FCN Cyanogen fluoride 1ΣC∞v
339 ClCN chlorocyanogen 1ΣC∞v
340 FNO Nitrosyl fluoride 1A'Cs
341 FNS Thionitrosyl fluoride 1A'Cs
342 FSN Thiazyl fluoride 1A'Cs
343 OPCl Phosphorus oxychloride   
344 CF2 Difluoromethylene 1A1D∞h
345 GeCl2 Germanium dichloride 1A1C2v
346 FOO Dioxygen monofluoride radical 2A"Cs
347 OClO Chlorine dioxide 2B1D∞h
348 ClSO Sulfur chloride oxide 2A"Cs
349 FClO chlorosyl fluoride 1A'Cs
350 F2O Difluorine monoxide 1A1C2v
351 ClOF Chlorine hypofluorite 1A'Cs
352 SF2 sulfur difluoride 1A1C2v
353 SCl2 Sulfur dichloride 1A1C2v
354 SeCl2 Selenium Dichloride   
355 SBr2 Sulfur dibromide   
356 SeBr2 Selenium dibromide   
357 HCCF Fluoroacetylene 1ΣC∞v
358 CH2F2 Methane, difluoro- 1A1C2v
359 C4 Carbon tetramer 3ΣgD∞h
360 C2N2 Cyanogen 1ΣgD∞h
361 S2N2 Disulfur dinitride 1AGD2h
362 CS3-- Carbonotrithioate   
363 NO3 Nitrogen trioxide 2A1'all bonds equal
364 SO3 Sulfur trioxide 1A1'D3h
365 S4 Sulfur tetramer   
366 S4 Sulfur tetramer   
367 S4 Sulfur tetramer   
368 H3AlO3 Aluminum hydroxide   
369 CH3CSNH2 Ethanethioamide   
370 C2F2 difluoroacetylene 1ΣgD∞h
371 N2F2 (Z)-Difluorodiazene 1A1C2v
372 N2F2 Dinitrogen difluoride, (E)- 1AgC2h
373 CF2O Carbonic difluoride 1A1C2v
374 BF3 Borane, trifluoro- 1A'D3h
375 AlF3 Aluminum trifluoride 1A1'D3h
376 SiF3 Silicon trifluoride radical 2A1C3v
377 ClO2F Chloryl fluoride 1A'Cs
378 F2SO Thionyl Fluoride 1A'Cs
379 SSCl2 Thiothionyl chloride   
380 SF3 Sulfur trifluoride 2A'Cs
381 ClF3 Chlorine trifluoride 1A1'D3h
382 ClF3 Chlorine trifluoride 1A1C2v
383 HClO3 Chloric Acid 1AC1
384 N2O3 Dinitrogen trioxide 1A'Cs
385 C3O2 Carbon suboxide 1A1C2v
386 C2H6O2S Dimethyl sulfone 1A1C2v
387 CF2Cl2 difluorodichloromethane 1A1C2v
388 SF4 Sulfur tetrafluoride 1A1C2v
389 HClO4 perchloric acid 1ACs
390 SiH3CCl3 (trichloromethyl)silane 1A1C3v
391 B2Cl4 Diboron tetrachloride 1A1D2
392 SiF5- silicon pentafluoride anion   
393 SOF4 Sulfur tetrafluoride oxide 1A1C2v
394 PF5 Phosphorus pentafluoride 1A1'D3h
395 ClF5 chlorinepentafluoride 1A1C4v
396 CHCl2CHCl2 Ethane, 1,1,2,2-tetrachloro-   
397 PF6- Hexafluorophosphate ion 1A1GOh
398 SF6 Sulfur Hexafluoride 1A1GOh
399 SF5Cl sulfur chloropentafluoride 1A1C4v
400 Al2Cl6 Aluminum, di-μ-chlorotetrachlorodi- 1AGD2h

Species NOT done yet
count Species Name file name problem
1 D- Deuterium atom anion d-  
2 D+ Deuterium atom cation d+  
3 H- Hydrogen atom anion h-  
4 H2+ Hydrogen cation h2+  
5 H3+ hydrogen trimer cation h3+  
6 He- Helium atom anion he-  
7 He+ Helium atom cation he+  
8 HeH Helium hydride heh  
9 Li- Lithium atom anion li-  
10 Li+ Lithium atom cation li+  
11 Na- Sodium atom anion na-  
12 Na+ Sodium atom cation na+  
13 K Potassium atom k  
14 K- Potassium atom anion k-  
15 K+ Potassium atom cation k+  
16 Cu Copper atom cu  
17 Cu- Copper atom anion cu-  
18 Cu+ Copper atom cation cu+  
19 KH Potassium hydride kh  
20 KH+ Potassium hydrogen cation kh+  
21 CuH Copper monohydride cuh  
22 Be- Beryllium atom anion be-  
23 Be+ Beryllium atom cation be+  
24 Mg- Magnesium atom anion mg-  
25 Mg+ Magnesium atom cation mg+  
26 Ca Calcium atom ca  
27 Ca- Calcium atom anion ca-  
28 Ca+ Calcium atom cation ca+  
29 Zn Zinc atom zn  
30 Zn- Zinc atom anion zn-  
31 Zn+ Zinc atom cation zn+  
32 CaH Calcium monohydride cah  
33 CaH+ Calcium monohydride cation cah+  
34 TiH Titanium monohydride tih  
35 ZnH Zinc monohydride znh  
36 ZnH+ Zinc, protonated znh+  
37 BeH2+ Beryllium dihydride cation beh2+  
38 CaH2 Calcium Hydride cah2  
39 ZnH2 Zinc hydride znh2  
40 B- Boron atom anion b-  
41 B+ Boron atom cation b+  
42 Al- Aluminum atom anion al-  
43 Al+ Aluminum atom cation al+  
44 Sc Scandium atom sc  
45 Sc+ Scandium cation sc+  
46 Ga Gallium atom ga  
47 Ga- Gallium atom anion ga-  
48 Ga+ Gallium atom cation ga+  
49 ScH Scandium monohydride sch  
50 ScH+ Scandium monohydride cation sch+  
51 GaH Gallium monohydride gah  
52 GaH+ Gallium monohydride cation gah+  
53 BH2- boron dihydride anion bh2-  
54 BH2+ Boron dihydride cation bh2+  
55 AlH2- aluminum dihydride anion alh2-  
56 AlH2+ aluminum dihydride cation alh2+  
57 BH3- boron trihydride anion bh3-  
58 AlH3- aluminum trihydride anion alh3-  
59 AlH3+ aluminum trihydride cation alh3+  
60 ScH3 Scandium trihydride sch3  
61 GaH3 Gallium trihydride gah3  
62 BH4 borohydride bh4  
63 BH4- borohydride anion bh4-  
64 C- Carbon atom anion c-  
65 C+ Carbon atom cation c+  
66 Si- Silicon atom anion si-  
67 Si+ Silicon atom cation si+  
68 Ti Titanium atom ti  
69 Ti- Titanium atom anion ti-  
70 Ti+ Titanium atom cation ti+  
71 Ge Germanium atom ge  
72 Ge- Germanium anion ge-  
73 Ge+ Germanium cation ge+  
74 Sn Tin atom sn  
75 Sn+ Tin cation sn+  
76 GeH germylidene geh  
77 GeH+ Germaniun monohyrdide cation geh+  
78 SiH2- silicon dihydride anion sih2-  
79 SiH2+ silicon dihydride cation sih2+  
80 GeH2 germylene geh2  
81 GeH2- germylene anion geh2-  
82 SiH3- Silyl anion sih3-  
83 GeH3 Germyl radical geh3  
84 GeH3+ germyl cation geh3+  
85 CD4 methane-d4 cd4  
86 CH2D2 methane-d2 ch2d2  
87 CH3D methane-d ch3d  
88 CH4- Methane anion ch4-  
89 CHD3 methane-d3 chd3  
90 SiH2D2 silane-d2 sih2d2  
91 SiH4+ Silane cation sih4+  
92 GeH4 Germane geh4  
93 SnH4 Stannane snh4  
94 SiH5+ Silane, protonated sih5+  
95 N Nitrogen atom n  
96 N- Nitrogen atom anion n-  
97 N+ Nitrogen atom cation n+  
98 P- Phosphorus atom anion p-  
99 P+ Phosphorus atom cation p+  
100 V Vanadium atom v  
101 V+ Vanadium atom cation v+  
102 As Arsenic atomic as  
103 As- Arsenic anion as-  
104 As+ Arsenic cation as+  
105 Sb Antimony atom sb  
106 AsH Arsenic monohydride ash  
107 AsH+ Arsenic monohydride cation ash+  
108 SbH Antimony monohydride sbh  
109 NH2+ Amino cation nh2+  
110 PH2- Phosphino anion ph2-  
111 PH2+ Phosphino cation ph2+  
112 AsH2 Arsenic dihydride ash2  
113 AsH2+ Arsenic dihydride cation ash2+  
114 NH3- Ammonia anion nh3-  
115 NH3+ ammonia cation nh3+  
116 PH3+ Phosphine cation ph3+  
117 AsH3 Arsine ash3  
118 AsH3+ Arsine cation ash3+  
119 SbH3 Stibine sbh3  
120 AsH4+ Arsonium ash4+  
121 NH4 Ammonium radical nh4  
122 NH4+ ammonium cation nh4+  
123 PH4 Phosphoranyl radical ph4  
124 O- Oxygen atom anion o-  
125 O+ Oxygen atom cation o+  
126 S- Sulfur atom anion s-  
127 S+ Sulfur atom cation s+  
128 Cr Chromium atom cr  
129 Se Selenium atom se  
130 Se- Selenium atom anion se-  
131 Se+ Selenium atom cation se+  
132 Te Tellurium atom te  
133 Te+ Tellurium atom cation te+  
134 CrH Chromium hydride crh  
135 CrH+ Chromium hydride cation crh+  
136 HSe Selenium monohydride hse  
137 HSe- selenium monohydride anion hse-  
138 HSe+ selenium monohydride cation hse+  
139 TeH Telluryl radical teh  
140 H2S- Hydrogen sulfide anion h2s-  
141 H2Se Hydrogen selenide h2se  
142 H2Se+ Hydrogen selenide cation h2se+  
143 H2Te Hydrogen Telluride h2te  
144 H3Se+ Hydrogen Selenide, protonated h3se+  
145 F- Fluorine atom anion f-  
146 F+ Fluorine atom cation f+  
147 Cl- Chlorine atom anion cl-  
148 Cl+ Chlorine atom cation cl+  
149 Mn Manganese atom mn  
150 Br Bromine atom br  
151 Br- Bromine atom anion br-  
152 Br+ Bromine atom cation br+  
153 I Iodine atom iodine  
154 I- Iodine atom anion iodine-  
155 I+ Iodine atom cation iodine+  
156 DCl Hydrochloric acid-d dcl  
157 HBr hydrogen bromide hbr  
158 HBr- hydrogen bromide anion hbr-  
159 HBr+ hydrogen bromide cation hbr+  
160 HI Hydrogen iodide hi  
161 HI+ Hydrogen iodide cation hi+  
162 H2F+ dihydrogen fluoride cation h2f+  
163 H2Br+ protonated hydrogen bromide h2br+  
164 H2I+ Iodonium h2i+  
165 Ne- Neon atom anion ne-  
166 Ne+ Neon atom cation ne+  
167 Ar Argon atom ar  
168 Ar- Argon atom anion ar-  
169 Ar+ Argon atom cation ar+  
170 Fe Iron atom fe  
171 Kr Krypton atom kr  
172 Kr+ Krypton cation kr+  
173 Xe Xenon atom xe  
174 HeLi+ Helium Lithium cation heli+  
175 NeH neon hydrogen neh  
176 ArH+ Argon hydride cation arh+  
177 KrH+ Protonated Krypton krh+  
178 XeH+ Xenon, protonated xeh+  
179 H2Ar H2 Ar dimer h2ar  
180 Co Cobalt atom cobalt  
181 Ni Nickel atom ni  
182 Li2+ lithium diatomic cation li2+  
183 LiK Lithium Potassium lik  
184 NaK Sodium Potassium nak  
185 NaK+ Sodium Potassium diatomic cation nak+  
186 K2 Potassium diatomic k2  
187 Cu2 Copper diatomic cu2  
188 LiBe Lithium Beryllium libe  
189 LiMg Lithium magnesium limg  
190 NaBe Sodium Beryllium nabe  
191 NaMg Sodium Magnesium namg  
192 Be2 Beryllium diatomic be2  
193 BeMg Beryllium Magnesium bemg  
194 Ca2 Calcium diatomic ca2  
195 LiB Lithium boride lib  
196 LiAl Lithium Aluminum lial  
197 NaAl Sodium aluminum naal  
198 BeB Beryllium monoboride beb  
199 B2+ Boron diatomic cation b2+  
200 BGa Boron Gallium bga  
201 AlGa Aluminum Gallium alga  
202 Ga2 Gallium diatomic ga2  
203 HBBH Diborane(2) hbbh  
204 LiBH4 Lithium borohydride libh4  
205 B2H4 Diborane(4) D2d b2h4  
206 HBHHBH Diborane(4) C2V hbhhbh  
207 B2H6+ Diborane cation b2h6  
208 Al2H6 dialane al2h6  
209 Ga2H6 digallane ga2h6  
210 LiC Lithium Carbide lic  
211 BeC Beryllium Carbide bec  
212 CaC Calcium monocarbide cac  
213 BC boron monocarbide bc  
214 BC- boron monocarbide anion bc-  
215 BSi Boron silicide bsi  
216 C2+ carbon diatomic cation c2+  
217 SiC- silicon monocarbide anion sic-  
218 SiC+ silicon monocarbide cation sic+  
219 Si2- silcon diatomic anion si2-  
220 Si2+ silcon diatomic cation si2+  
221 GeC Germanium monocarbide gec  
222 SiGe Silicon Germanium sige  
223 Ge2 Germanium diatomic ge2  
224 ZnCH2 Zinc methylene znch2  
225 H2CC- vinylidene anion h2cc-  
226 HCCH- acetylene anion c2h2-  
227 Si2H2 disilyne si2h2  
228 CH3Li methyl lithium ch3li  
229 CuCH3 monomethyl copper cuch3  
230 ZnCH3 Zinc monomethyl znch3  
231 CH2BH methyleneborane ch2bh  
232 C2H3- vinyl anion c2h3-  
233 C2H4- Ethylene anion c2h4-  
234 CH2SiH2 silaethylene ch2sih2  
235 Si2H4 Disilene si2h4  
236 CH3BH2 methylborane ch3bh2  
237 C2H5- Ethyl anion c2h5-  
238 C2H5+ Ethyl cation c2h5+  
239 C2H6+ ethane cation c2h6+  
240 CH3SiH3 methyl silane ch3sih3  
241 GeH3CH3 methyl germane geh3ch3  
242 C2H7+ Ethane, protonated c2h7+  
243 LiP Lithium monophosphide lip  
244 BeN Beryllium mononitride ben  
245 BeN+ Beryllium mononitride cation ben+  
246 MgN Magnesium Nitride mgn  
247 AlN- aluminum mononitride anion aln-  
248 AlN+ aluminum mononitride cation aln+  
249 BP Boron monophosphide bp  
250 AlP Aluminum monophosphide alp  
251 GaN Gallium mononitride gan  
252 GaP Gallium monophosphide gap  
253 GaAs Gallium arsenide gaas  
254 CP- carbon monophosphide anion cp-  
255 CP+ carbon monophosphide cation cp+  
256 SiN- silicon mononitride anion sin-  
257 SiN+ silicon mononitride cation sin+  
258 SiP- Silicon monophosphide anion sip-  
259 SiP+ Silicon monophosphide cation sip+  
260 TiN Titanium mononitride tin  
261 PN- phosphorus nitride anion pn-  
262 PN+ phosphorus nitride cation pn+  
263 P2- phosphorus diatomic anion p2-  
264 P2+ phosphorus diatomic cation p2+  
265 AsN Arsenic mononitride asn  
266 AsP Arsenic monophosphide asp  
267 SbN Antimony nitride sbn  
268 As2 Arsenic diatomic as2  
269 HCN- Hydrogen cyanide anion hcn-  
270 HNC+ hydrogen isocyanide cation hnc+  
271 HCP Phosphaethyne hcp  
272 HCP+ Phosphaethyne cation hcp+  
273 NNH Dinitrogen monohydride nnh  
274 NNH+ Dinitrogen monohydride cation nnh+  
275 HPO Hydrogen phosphorus oxide hpo  
276 HPO+ Hydrogen phosphorus oxide cation hpo+  
277 LiNH2 lithium amide linh2  
278 HBNH Boranimine hbnh  
279 CNH2 Aminomethylidyne radical cnh2  
280 CNH2+ N-protonated hydrogen isocyanide cnh2+  
281 H2CN Dihydrogen cyanide radical h2cn  
282 H2CN+ hydrocyanonium cation h2cn+  
283 HCNH methyleneazane hcnh  
284 HCNH+ N-protonated HCN hcnh+  
285 H2NN Isodiazene h2nn  
286 N2H2 (Z)-Diazene n2h2z  
287 N2H2+ trans-diazene cation n2h2+  
288 CH2NH Methanimine ch3n  
289 CH2NH+ Methanimine cation ch2nh+  
290 CHNH2 aminomethylene chnh2  
291 CHNH2+ Aminocarbene cation chnh2+  
292 BH2NH2 Boranamine bh2nh2  
293 N2H4 Hydrazine n2h4  
294 N2H4+ hydrazine cation n2h4+  
295 P2H4 Diphosphine p2h4  
296 CH3NH2 methyl amine ch3nh2  
297 CH3NH2+ methyl amine cation ch3nh2+  
298 CH3PH2 Methyl phosphine ch3ph2  
299 SiH3NH2 Silane, amino sih3nh2  
300 N2H5+ protonated hydrazine n2h5+  
301 BH3NH3 borane ammonia bh3nh3  
302 CH3NH3 methyl ammonium radical ch3nh3  
303 CH3PH3+ methyl phosphine, protonated ch3ph3+  
304 NH3NH3 Ammonia Dimer nh3nh3  
305 N2H7+ ammonia ammonium dimer n2h7+  
306 LiS+ Lithium sulfide cation lis+  
307 KO Potassium monoxide ko  
308 KO+ Potassium monoxide cation ko+  
309 NaS Sodium sulfide nas  
310 CuO Copper Monoxide cuo  
311 LiSe Lithium monoselenide lise  
312 CaO Calcium monoxide cao  
313 MgS- magnesium sulfide anion mgs-  
314 MgS+ magnesium sulfide cation mgs+  
315 ZnO zinc monoxide zno  
316 ZnS Zinc sulfide zns  
317 BeS- Beryllium monosulfide anion bes-  
318 BeS+ Beryllium monosulfide cation bes+  
319 AlO- Aluminum monoxide anion alo-  
320 AlO+ aluminum monoxide cation alo+  
321 BS- boron monosulfide anion bs-  
322 BS+ boron monosulfide cation bs+  
323 AlS- aluminum monosulfide anion als-  
324 AlS+ aluminum monosulfide cation als+  
325 ScO Scandium monoxide sco  
326 GaO Gallium monoxide gao  
327 GaS Gallium monosulfide gas  
328 CS- carbon monosulfide anion cs-  
329 CS+ carbon monosulfide cation cs+  
330 SiO- silicon monoxide anion sio-  
331 SiO+ silicon monoxide cation sio+  
332 SiS- silicon monosulfide anion sis-  
333 SiS+ silicon monosulfide cation sis+  
334 TiO Titanium monoxide tio  
335 CSe Carbon monoselenide cse  
336 CSe- Carbon monoselenide anion cse-  
337 CSe+ Carbon monoselenide cation cse+  
338 GeO+ Germanium monoxide cation geo+  
339 GeS Germanium monosulfide ges  
340 SiSe+ Silicon Monoselenide cation sise+  
341 GeSe Germanium monoselenide gese  
342 NS- nitrogen sulfide anion ns-  
343 NS+ nitrogen sulfide cation ns+  
344 PO- phosphorus monoxide anion po-  
345 PO+ phosphorus monoxide cation po+  
346 PS- phosphorus monosulfide anion ps-  
347 PS+ phosphorus monosulfide cation ps+  
348 VO Vanadium monoxide vo  
349 AsO Arsenic monoxide aso  
350 NSe Nitrogen monoselenide nse  
351 AsS Arsenic monosulfide ass  
352 PSe Phosphorus monoselenide pse  
353 AsSe Arsenic monoselenide asse  
354 O2-- dioxygen dianion o2--  
355 SO- sulfur monoxide anion so-  
356 S2- sulfur diatomic anion s2-  
357 SeO Selenium monoxide seo  
358 SeO- selenium monoxide anion seo-  
359 SeO+ selenium monoxide cation seo+  
360 SeS Selenium monosulfide ses  
361 SeS- selenium monosulfide anion ses-  
362 SeS+ selenium monosulfide cation ses+  
363 TeO Tellurium monoxide teo  
364 Se2- selenium diatomic anion se2-  
365 Se2+ selenium diatomic cation se2+  
366 Te2 Tellurium diatomic te2  
367 NaOH sodium hydroxide naoh  
368 KOH Potassium hydroxide koh  
369 BeOH beryllium monohydroxide beoh  
370 CaOH Calcium monohydroxide caoh  
371 HBO Boron hydride oxide hbo  
372 HBS hydrogen boron sulfide hbs  
373 COH Hydroxymethylidyne coh  
374 COH+ Carbon Monoxide, protonated coh+  
375 HCO- formyl anion hco-  
376 HCS- Thioformyl anion hcs-  
377 HCS+ Thioformyl cation hcs+  
378 NOH Hydroxyimidogen noh  
379 NOH+ O-protonated nitric oxide noh+  
380 HNS Sulfur imide hns  
381 HNS- Sulfur imide anion hns-  
382 HO2+ Hydroperoxy cation ho2+  
383 HS2 Thiosulfeno radical hs2  
384 H2CO- formaldehyde anion h2co-  
385 HOCH hydroxycarbene hoch  
386 H2CS- thioformaldehyde anion h2cs-  
387 H2CS+ thioformaldehyde cation h2cs+  
388 H2NO nitroxide h2no  
389 H2O2+ Hydrogen peroxide cation h2o2+  
390 H2OO water oxide h2oo  
391 HOSH hydrogen thioperoxide hosh  
392 H2Se2 hydrogen diselenide h2se2  
393 CH2OH Hydroxymethyl radical ch2oh  
394 CH3O Methoxy radical ch3o  
395 CH3O- methoxy anion ch3o-  
396 CH3O+ Methoxy cation ch3o+  
397 CH3S thiomethoxy ch3s  
398 NH2OH+ Hydroxylamine cation nh2oh+  
399 NH3O Ammonia Oxide nh3o  
400 NH2SH Thiohydroxylamine nh2sh  
401 NH3S sulfidoazane nh3s  
402 H3O2+ hydrogen peroxide, protonated h3o2+  
403 CH3OH- Methyl alcohol anion ch3oh-  
404 CH3OH+ Methyl alcohol cation ch3oh+  
405 CH3SH+ Methanethiol cation ch3sh+  
406 SiH3OH silanol sih3oh  
407 CH3SeH Methane selenol ch3seh  
408 NH2OH2+ protonated hydroxylamine nh2oh2+  
409 NH3OH+ N-protonated hydroxylamine nh3oh+  
410 H2OH2O water dimer h2oh2o  
411 CH3OH2+ Methanol, protonated ch3oh2+  
412 H2ONH3 Water Ammonia Dimer h2onh3  
413 H5O2+ Dihydroxonium ion h5o2+  
414 LiCl- lithium chloride anion licl-  
415 LiCl+ lithium chloride cation licl+  
416 KF Potassium Fluoride kf  
417 NaCl- sodium chloride anion nacl-  
418 NaCl+ sodium chloride cation nacl+  
419 KCl Potassium Chloride kcl  
420 CuF Copper monofluoride cuf  
421 LiBr Lithium Bromide libr  
422 LiBr- lithium bromide anion libr-  
423 LiBr+ lithium bromide cation libr+  
424 CuCl Copper monochloride cucl  
425 NaBr Sodium Bromide nabr  
426 NaBr- sodium bromide anion nabr-  
427 NaBr+ sodium bromide cation nabr+  
428 KBr Potassium Bromide kbr  
429 LiI Lithium Iodide lii  
430 NaI Sodium Iodide nai  
431 KI Potassium Iodide ki  
432 BeCl beryllium monochloride becl  
433 CaF Calcium monofluoride caf  
434 MgCl magnesium monochloride mgcl  
435 MgCl- magnesium monochloride anion mgcl-  
436 MgCl+ magnesium monochloride cation mgcl+  
437 CaCl calcium monochloride cacl  
438 TiCl Titanium Monochloride ticl  
439 ZnF Zinc monofluoride znf  
440 ZnF- Zinc monofluoride anion znf-  
441 ZnF+ Zinc monofluoride cation znf+  
442 ZnCl Zinc monochloride zncl  
443 CaBr Calcium monobromide cabr  
444 BeCl- beryllium monochloride anion becl-  
445 BeCl+ beryllium monochloride cation becl+  
446 AlF- Aluminum monofluoride anion alf-  
447 AlF+ Aluminum monofluoride cation alf+  
448 BCl- boron monochloride anion bcl-  
449 BCl+ boron monochloride cation bcl+  
450 AlCl- aluminum monochloride anion alcl-  
451 AlCl+ aluminum monochloride cation alcl+  
452 ScF Scandium monofluoride scf  
453 BBr Boron monobromide bbr  
454 GaF Gallium monofluoride gaf  
455 GaF+ Gallium monofluoride cation gaf+  
456 AlBr Aluminum monobromide albr  
457 GaCl Gallium monochloride gacl  
458 GaCl+ Gallium monochloride cation gacl+  
459 AlI Aluminum monoiodide ali  
460 GaBr Gallium monobromide gabr  
461 CCl carbon monochloride ccl  
462 CCl- carbon monochloride anion ccl-  
463 CCl+ carbon monochloride cation ccl+  
464 SiF- silicon monofluoride anion sif-  
465 SiCl- silicon monochloride anion sicl-  
466 SiCl+ silicon monochloride cation sicl+  
467 CBr Carbon monobromide cbr  
468 GeF Germanium monofluoride gef  
469 GeF+ Germanium monofluoride cation gef+  
470 GeCl Germanium monochloride gecl  
471 GeCl+ Germanium monochloride cation gecl+  
472 SiBr Silicon monobromide sibr  
473 SiBr+ Silicon monobromide cation sibr+  
474 NCl- nitrogen monochloride anion ncl-  
475 NCl+ nitrogen monochloride cation ncl+  
476 PF- phosphorus monofluoride anion pf-  
477 PF+ phosphorus monofluoride cation pf+  
478 PCl phosphorus chloride pcl  
479 PCl- phosphorus monochloride anion pcl-  
480 PCl+ phosphorus monochloride cation pcl+  
481 AsF Arsenic monofluoride asf  
482 NBr nitrogen monobromide nbr  
483 AsCl Arsenic monochloride ascl  
484 PBr Phosphorus monobromide pbr  
485 SbF Antimony monofluoride sbf  
486 SbCl Antimony monochloride sbcl  
487 ClO- chlorine monoxide anion clo-  
488 ClO+ chlorine monoxide cation clo+  
489 SF- sulfur monofluoride anion sf-  
490 SCl- sulfur monochloride anion scl-  
491 BrO Bromine monoxide bro  
492 BrO- Bromine monoxide anion bro-  
493 BrO+ Bromine monoxide cation bro+  
494 SeF Selenium monofluoride sef  
495 SBr+ Sulfur monobromide cation sbr+  
496 SeCl Selenium monochloride secl  
497 IO Iodine monoxide io  
498 SeBr Selenium monobromide sebr  
499 BrCl Bromine monochloride brcl  
500 ClF- clorine monofluoride anion clf-  
501 ClF+ clorine monofluoride cation clf+  
502 BrF Bromine monofluoride brf  
503 BrF- bromine fluoride anion brf-  
504 BrF+ bromine fluoride cation brf+  
505 BrCl- bromine chloride anion brcl-  
506 BrCl+ bromine chloride cation brcl+  
507 IF Iodine monofluoride if  
508 Br2 Bromine diatomic br2  
509 Br2- bromine diatomic anion br2-  
510 Br2+ bromine diatomic cation br2+  
511 ICl Iodine monochloride icl  
512 IBr Iodine monobromide ibr  
513 I2 Iodine diatomic i2  
514 I2+ Iodine diatomic cation i2+  
515 HCF Fluoromethylene hcf  
516 HCCl Chloromethylene hccl  
517 HSiF fluorosilylene hsif  
518 HSiCl Chlorosilylene hsicl  
519 HSiBr monobromosilylene hsibr  
520 CHBr bromomethylene chbr  
521 DOCl Hypochlorous acid-d docl  
522 HOCl+ hypochlorous acid cation hocl+  
523 HOBr Hypobromous acid hobr  
524 HOBr+ Hypobromous acid cation hobr+  
525 HOI Hypoiodous acid hoi  
526 F2H+ Fluorine, protonated f2h+  
527 FHF Hydrogen difluoride fhf  
528 FHF- Hydrogen difluoride anion fhf-  
529 ClFH+ Chlorine fluoride, F-protonated clfh+  
530 FClH+ Chlorine fluoride, Cl-protonated fclh+  
531 Cl2H+ Chlorine, protonated cl2h+  
532 CH2Br bromomethyl radical ch2br  
533 CH2F fluoromethyl radical ch2f  
534 CH2F+ fluoromethyl cation ch2f+  
535 CH2Cl+ chloromethyl cation ch2cl+  
536 CH2Cl chloromethyl radical ch2cl  
537 NH2Cl chloramine nh2cl  
538 H2F2 Hydrogen fluoride dimer h2f2  
539 CH3F+ methyl fluoride cation ch3f+  
540 CD3F methylfluoride-d3 cd3f  
541 CH3F Methyl fluoride ch3f  
542 CD3Cl methyl chloride d3 cd3cl  
543 CH3Cl+ Methyl chloride cation ch3cl+  
544 SiH3F monofluorosilane sih3f  
545 CH3Br methyl bromide ch3br  
546 GeH3F monofluorogermane geh3f  
547 GeH3Cl monochlorogermane geh3cl  
548 SiH3Br bromosilane sih3br  
549 CH3I methyl iodide ch3i  
550 SiH3I Silyl Iodide sih3i  
551 NH3Cl+ protonated monochloroammonia nh3cl+  
552 CH3ClH+ methyl chloride, protonated ch3clh+  
553 NH4Cl Ammonium chloride nh4cl  
554 LiNe+ Lithium Neon cation line+  
555 Ne2 Neon diatomic ne2  
556 Ne2+ Neon diatomic cation ne2+  
557 Ar2 Argon diatomic ar2  
558 Ar2+ Argon diatomic cation ar2+  
559 Li3 Lithium trimer li3  
560 Li3+ Lithium trimer cation li3+  
561 C3+ carbon trimer cation c3+  
562 SiC2 Silicon dicarbide sic2  
563 C3H3 cyclopropenyl radical cpr  
564 C3H3 Propargyl radical propargyl  
565 C3H3- Propargyl anion c3h3-  
566 C3H4 cyclopropene cprop  
567 CH3CCH propyne propyne  
568 C3H5 Allyl radical allyl  
569 C3H5+ Allyl cation allyl+  
570 CH3CHCH 1-propenyl radical ch3chch  
571 Zn(CH3)2 dimethyl zinc dmz  
572 C3H6 Cyclopropane c3h6  
573 CH2CHCH3 Propene propene  
574 C3H7 n-Propyl radical npropyl  
575 C3H7+ cyclopropane, protonated c3h7+  
576 CH3CHCH3 Isopropyl radical isopropyl  
577 CH3CHCH3+ Isopropyl cation prop2yl+  
578 C3H8 Propane propane  
579 SiH2(CH3)2 dimethylsilane dms  
580 LiCN lithium cyanide licn  
581 NaCN Sodium Cyanide nacn  
582 KCN Potassium cyanide kcn  
583 CuCN Copper cyanide cucn  
584 ZnCN Zinc monocyanide zncn  
585 ZnNC Zinc isocyanide znnc  
586 AlCN Aluminum monocyanide alcn  
587 AlNC Aluminum isocyanide alnc  
588 CN2 3H-Diazirin-3-ylidene cn2  
589 CNN Diazocarbene cnn  
590 NCN Cyanoimidogen ncn  
591 N3+ azide cation n3+  
592 HCCN cyanomethylene hccn  
593 HCNN diazomethyl radical hcnn  
594 HN3+ Hydrazoic acid cation hn3+  
595 HNCNH diiminomethane hncnh  
596 CH2N2 diazirine ch2n2  
597 CH2NN diazomethane ch2nn  
598 NH2CN cyanamide cyanamide  
599 HNNNH+ 1,2-Triazadienium n2h3+  
600 NH2NN+ hydrazoic acid, protonated nh2nn+  
601 CH3CN Acetonitrile ch3cn  
602 CH3CN- acetonitrile anion ch3cn-  
603 CH3CN+ Acetonitrile cation ch3cn+  
604 CH3NC methyl isocyanide ch3nc  
605 CHNCH2 2H-Azirine c157164  
606 CHNHCH 1H-Azirine chnhch  
607 H2CCNH Ethenimine ch2cnh  
608 H2CNCH methyleneaminomethylene ch2nch  
609 HCCNH2 Ethynamine hccnh2  
610 HCNCH2+ 2H-Azirine cation hcnch2+  
611 HNCNH2+ diiminomethane, protonated hncnh2+  
612 NCNH3+ Cyanamide, protonated ncnh3+  
613 NH2CNH+ cyanamide, cn protonated nh2cnh+  
614 NH3CN+ cyanamide, amine protonated nh3cn+  
615 CH2CHNH vinylazine ch2chnh  
616 CH3CHN methylmethaniminyl radical ch3chn  
617 NHCHNH2 aminomethanimine cn2h4  
618 C2H5N Aziridine c2h5n  
619 CH2CHNH2 aminoethene aminoethene  
620 CH3CHNH ethanimine ethanimine  
621 NH2BHNH2 diaminoborane nh2bhnh2  
622 C2H5NH+ Protonated Aziridine c2h5nh+  
623 C2H6N+ aziridine, protonated c2h6n+  
624 NH2CH2NH2 diaminomethane nh2ch2nh2  
625 CH3CH2NH2 Ethylamine etam  
626 CH3NHCH3 Dimethylamine ch3nhch3  
627 CH3PHCH3 dimethylphosphine ch3phch3  
628 NH2CH2NH3+ diaminoethane, protonated pdam  
629 (CH3)2NH2+ dimethylammonium cation dmam  
630 CH3CH2NH3+ ethylamine, protonated pea  
631 Na2O disodium monoxide na2o  
632 Na2S Sodium sulfide na2s  
633 LiO2 Lithium dioxide lio2  
634 NaO2 Sodium superoxide nao2  
635 CCO Dicarbon monoxide cco  
636 CNO- fulminate cno-  
637 SCN thiocyanato radical scn  
638 SCN- thiocyanide anion scn-  
639 BO2 Boron dioxide bo2  
640 BO2+ Boron dioxide cation bo2+  
641 N2O- Nitrous oxide anion n2o-  
642 PPO Phosphorus oxide phosphide ppo  
643 OCS+ Carbonyl sulfide cation cos+  
644 SiO2 silicon dioxide sio2  
645 CS2- Carbon disulfide anion cs2-  
646 CS2+ Carbon disulfide cation cs2+  
647 TiO2 Titanium dioxide tio2  
648 GeO2 Germanium dioxide geo2  
649 OCSe Carbonyl selenide ocse  
650 SCSe Carbon sulfide selenide scse  
651 GeS2 Germanium disulfide ges2  
652 CSe2 Carbon diselenide cse2  
653 SCTe Carbon sulfide Telluride scte  
654 PO2 Phosphorus dioxide po2  
655 PO2- Phosphorus dioxide anion po2-  
656 PO2+ Phosphorus dioxide cation po2+  
657 AsO2 Aresenic dioxide aso2  
658 SO2- Sulfur dioxide anion so2-  
659 SO2+ Sulfur dioxide cation so2+  
660 SSO Disulfur monoxide sso  
661 S3- Sulfur trimer anion s3-  
662 SeO2 Selenium dioxide seo2  
663 SeO2+ Selenium dioxide cation seo2+  
664 TeO2 Tellurium Dioxide teo2  
665 CS2H+ Carbon disulfide, protonated cs2h+  
666 HNCO Isocyanic acid hnco  
667 HOCN cyanic acid hocn  
668 HNCS Isothiocyanic acid hncs  
669 HSCN thiocyanic acid hscn  
670 HCO2- formate anion hco2-  
671 HNNO nitrosoazane hnno  
672 HNNO+ Nitrous oxide, N-protonated hnno+  
673 NNOH+ Nitrous Oxide, O-protonated nnoh+  
674 HCOO formate neutral radical hcoo  
675 HNO2 Nitrous acid hno2  
676 O3H+ protonated ozone o3h+  
677 SO2H+ protonated sulfur dioxide so2h+  
678 C2H2O Oxirene oxirene  
679 CH2CO Ketene ch2co  
680 Be(OH)2 Beryllium hydroxide beo2h2  
681 Mg(OH)2 Magnesium dihydroxide h2mgo2  
682 NH2NO Nitrosamide nh2no  
683 CH2O2 Dioxirane diox  
684 H2COO Dioxymethyl radical h2coo  
685 H2COO+ dioxymethyl cation h2coo+  
686 H2O3 Hydrogen trioxide h2o3  
687 NaOCH3 Sodium methoxide naoch3  
688 CH2BOH hydroxy(methylene)borane ch2boh  
689 BH3CO Borane carbonyl bh3co  
690 CH3BO Borane, methyloxo- ch3bo  
691 CH2CHO Vinyloxy radical ch2cho  
692 CH2COH+ ketene, protonated ch2coh+  
693 CH3CO- Acetyl anion ch3co-  
694 CH3CO+ acetyl cation ch3co+  
695 CH2NOH formaldoxime ch2noh  
696 CH3NO nitrosomethane ch3no  
697 CHONH2 formamide formamide  
698 CNOH3 1,2-oxaziridine cnoh3  
699 HOCHNH hydroxymethylimine hochnh  
700 CHSNH2 thioformamide chsnh2  
701 NHCHSH Methanimidothioic acid nhchsh  
702 CH2OOH CH2OOH radical ch2ooh  
703 CH3OO- methylperoxy anion ch3oo-  
704 CH3OO+ methylperoxy cation ch3oo+  
705 C2H4O Ethylene oxide c2h4o  
706 C2H4O+ ethylene oxide cation c2h4o+  
707 CH2CHOH ethenol ch2choh  
708 CH3CHO Acetaldehyde ch3cho  
709 CH3CHO+ acetaldehyde cation ch3cho+  
710 H2COCH2+ Methyl, (methyleneoxoniumyl)- h2coch2+  
711 CH2CHSH Ethenethiol ch2chsh  
712 H2CONH2+ protonated formamide h2conh2+  
713 NH2CHOH+ Formamide, O-protonated nh2choh+  
714 NH3CHO+ Formamide, N-Protonated nh3cho+  
715 CH2(OH)2 methanediol ch2o2h2  
716 CH3OOH Methyl peroxide ch3ooh  
717 HSCH2SH Methanedithiol ch4s2  
718 H2OH2CO water formaldehyde dimer h2oh2co  
719 C2H4OH+ ethylene oxide, protonated c2h4oh+  
720 CH2CH2OH 2-hydroxy ethyl radical ch2ch2oh  
721 CH3CH2O Ethoxy radical ethoxy  
722 CH3CHOH 1-hydroxy-ethyl radical ch3choh  
723 CH3CHOH+ acetaldehyde, protonated ch3choh+  
724 CH3OCH2 methoxymethyl radical ch3och2  
725 NH2CH2OH aminomethanol nh2ch2oh  
726 CH3CH2OH Ethanol etoh  
727 CH3OCH3 Dimethyl ether meome  
728 CH3SCH3 Dimethyl sulfide mesme  
729 CH3SCH3+ dimethyl sulfide cation mesme+  
730 CH3SeCH3 dimethylselenide dmse  
731 CH3OHH2O methanol water dimer ch3ohh2o  
732 H2OCH3OH water methanol dimer h2och3oh  
733 CuF2 Copper difluoride cuf2  
734 ZnF2 Zinc difluoride znf2  
735 CNF iso cyanogen fluoride cnf  
736 BrCN Cyanogen bromide brcn  
737 ICN Cyanogen iodide icn  
738 FBO Boron monofluoride monoxide fbo  
739 BeF2 Beryllium fluoride bef2  
740 MgF2 Magnesium fluoride mgf2  
741 BeCl2 Beryllium chloride becl2  
742 MgCl2 Magnesium dichloride mgcl2  
743 CaCl2 Calcium Chloride cacl2  
744 ZnCl2 Zinc dichloride zncl2  
745 BeBr2 Beryllium bromide bebr2  
746 CaBr2 Calcium dibromide cabr2  
747 CaF2 Calcium difluoride caf2  
748 FCO Carbonyl fluoride fco  
749 FCO+ Carbonyl fluoride cation fco+  
750 ClCO carbonyl monochloride clco  
751 BF2 Boron difluoride radical bf2  
752 ClNO Nitrosyl chloride clno  
753 BrNO Nitrosyl bromide brno  
754 INO Nitrosyl iodide ino  
755 CFCl chlorofluoromethylene cfcl  
756 SiF2 Silicon difluoride sif2  
757 SiF2+ Silicon difluoride cation sif2+  
758 CCl2 dichloromethylene ccl2  
759 CCl2- dichloromethylene anion ccl2-  
760 CCl2+ dichloromethylene cation ccl2+  
761 SiCl2 Dichlorosilylene sicl2  
762 GeF2 Germanium difluoride gef2  
763 CBr2 dibromomethylene cbr2  
764 FOO+ Fluorine dioxide cation foo+  
765 ClOO chloroperoxy radical cloo  
766 ClOO+ chloroperoxy cation cloo+  
767 OClO- Chlorine dioxide anion oclo-  
768 OClO+ Chlorine dioxide cation oclo+  
769 ClS2 Sulfur chloride cls2  
770 BrOO Bromine dioxide broo  
771 OBrO Bromine dioxide radical obro  
772 NF2 Difluoroamino radical nf2  
773 PF2 Phosphorus difluoride pf2  
774 PF2+ Phosphorus difluoride cation pf2+  
775 SF2- sulfur difluoride anion sf2-  
776 SF2+ sulfur difluoride cation sf2+  
777 Cl2O Dichlorine monoxide cl2o  
778 SeF2 Selenium difluoride sef2  
779 BrOCl Bromine hypochlorite brocl  
780 BrOBr Bromine oxide brobr  
781 F3- trifluoride anion f3-  
782 Cl3- trichloride anion cl3-  
783 Br3- tribromide anion br3-  
784 I3- triiodide i3-  
785 SFCl Sulfur chloride fluoride sfcl  
786 HCCF+ fluoroacetylene cation hccf+  
787 HCCCl Chloroacetylene hcccl  
788 HCCBr bromoacetylene hccbr  
789 HFCO formyl fluoride hfco  
790 HFCO+ formyl fluoride cation hfco+  
791 COHCl Formyl chloride cohcl  
792 COHBr Formyl bromide cohbr  
793 BHF2 Difluoroborane bhf2  
794 BHCl2 Borane, dichloro- bhcl2  
795 CHCl2 dichloromethyl radical chcl2  
796 CHF2 difluoromethyl radical chf2  
797 CHF2+ difluoromethyl cation chf2+  
798 CHFCl Chlorofluoromethyl radical chfcl  
799 CHFCl+ Chlorofluoromethyl cation chfcl+  
800 CHCl2+ dichloromethyl cation chcl2+  
801 CHBr2 dibromomethyl radical chbr2  
802 HOClO Chlorous acid hoclo  
803 NHF2 difluoramine nhf2  
804 NHCl2 dichloroamine nhcl2  
805 CH2FCl fluorochloromethane ch2fcl  
806 SiH2F2 difluorosilane sih2f2  
807 CH2Cl2 Methylene chloride ch2cl2  
808 CH2BrF Methane, bromofluoro- ch2fbr  
809 CH2BrCl Methane, bromochloro- ch2clbr  
810 CH2FI fluoroiodomethane ch2fi  
811 CH2Br2 dibromomethane ch2br2  
812 CH2ClI chloroiodomethane ch2cli  
813 CH2BrI bromoiodomethane ch2bri  
814 CH2I2 Diiodomethane ch2i2  
815 SiH2Cl2 dichlorosilane sih2cl2  
816 CH3MgBr Methyl Magnesium Bromide ch3mgbr  
817 CH2CHF Ethene, fluoro- ch2chf  
818 CH2CHF+ fluoroethene cation ch2chf+  
819 C2H3Cl Ethene, chloro- ch2chcl  
820 C2H3Br vinyl bromide c2h3br  
821 C2H3I Vinyl iodide c2h3i  
822 CH2FOH fluoromethanol ch2foh  
823 CH3OCl methyl hypochlorite ch3ocl  
824 CH2CH2Cl 2-chloroethyl radical ch2ch2cl  
825 CHClCH3 1-chloroethyl radical chclch3  
826 C2H5F fluoroethane c2h5f  
827 CH3CH2Cl Ethyl chloride c2h5cl  
828 CH3SiFH2 fluoromethylsilane ch3sifh2  
829 C2H5Br Ethyl bromide etbr  
830 C2H5I Ethyl iodide c2h5i  
831 KrF2 Krypton difluoride krf2  
832 XeF2 Xenon difluoride xef2  
833 B4H10 Tetraborane(10) b4h10  
834 C4+ Carbon tetramer cation c4+  
835 C4H2 Diacetylene c4h2  
836 C4H2+ diacetlyene cation c4h2+  
837 C2H3CCH 1-Buten-3-yne c2h3cch  
838 C4H4 cyclobutadiene cbd  
839 C4H4 Tetrahedrane c4h4  
840 H2CCCCH2 Butatriene h2cccch2  
841 C4H6 1-Methylcyclopropene c3100047  
842 C4H6 Cyclobutene c822355  
843 C4H6 Methylenecyclopropane c6142730  
844 CH2CCHCH3 1,2-Butadiene butad12  
845 CH2CHCHCH2 1,3-Butadiene c106990  
846 CH3CCCH3 2-Butyne c503173  
847 CHCCH2CH3 1-Butyne c107006  
848 CH3CHCHCH2 methylallyl radical c4h7  
849 C4H8 methylcyclopropane mcp  
850 CH2C(CH3)CH3 1-Propene, 2-methyl- isobute  
851 CH2CHCH2CH3 1-Butene bute1  
852 CH3CHCHCH3 2-Butene, (E)- bute2e  
853 CH3CHCHCH3 2-Butene, (Z)- bute2z  
854 B(CH3)3 trimethylborane bme3  
855 Al(CH3)3 trimethyl aluminum tma  
856 C(CH3)3 Tert-butyl radical tbutyl  
857 CH2CH(CH3)2 Isobutyl radical isobutyl  
858 CH3CHCH2CH3 2-Butyl radical butyl2  
859 CH3CH(CH3)CH3 Isobutane isobutane  
860 CH3CH2CH2CH3 Butane butane  
861 SiH(CH3)3 trimethylsilane trimsi  
862 Li3N trilithium nitride li3n  
863 C2N2+ Cyanogen cation c2n2+  
864 P4 Phosphorus tetramer p4  
865 As4 Arsenic tetramer as4  
866 HCCCN Cyanoacetylene hcccn  
867 HCCCN+ Cyanoacetylene cation hcccn+  
868 H2CNCN cyanamide, methylene ch2ncn  
869 HNCCNH Ethenediimine hnccnh  
870 C3H3N acrylonitrile ch2chcn  
871 C3H3N+ acrylonitrile cation ch2chcn+  
872 CH3N3 methyl azide ch3n3  
873 NH2CCNH2 Diaminoacetylene daa  
874 NH2CH2CN Aminoacetonitrile aan  
875 CH3NHN2+ methyl azide, protonated ch3nhn2+  
876 C2H5CN ethyl cyanide c2h5cn  
877 CH5N3 Guanidine guanidine  
878 C4H6 Bicyclo[1.1.0]butane c157335  
879 CH3NNCH3 (Z)-1,2-Dimethyldiazene dmdiazz  
880 H2NCHCHNH2 diaminoethylene dae  
881 CH6N3+ guanidinium ch6n3+  
882 C3H7N Cyclopropylamine cpram  
883 CH7N3 triaminomethane tam  
884 C3H7N Azetidine azet  
885 C4H8 cyclobutane cbutane  
886 C2H8N2 Ethylenediamine ethdiam  
887 CH3NHNHCH3 dimethyl hydrazine dmh  
888 CH3CH(NH2)CH3 2-Propanamine pram2  
889 N(CH3)3 Trimethylamine trimeam  
890 NH2CH2CH2CH3 1-Propanamine pram1  
891 P(CH3)3 trimethylphosphine tmp  
892 N(SiH3)3 trisilylamine tsa  
893 As(CH3)3 trimethyl arsine tmas  
894 (CH3)3NH+ protonated trimethyl amine ptma  
895 C3H7NH3+ n-propylamine, protonated c3h7nh2  
896 Li2O2 dilithium dioxide li2o2  
897 Na2O2 disodium dioxide na2o2  
898 K2O2 dipotassium dioxide k2o2  
899 C3O Tricarbon monoxide c3o  
900 B2O2 Diboron dioxide b2o2  
901 CO3 Carbon trioxide co3  
902 CO3-- carbonate co3--  
903 NO3- nitrate anion no3-  
904 NO3+ nitrogen trioxide cation no3+  
905 SO3- Sulfur trioxide anion so3-  
906 SO3-- Sulfate dianion so3--  
907 SO3+ Sulfur trioxide cation so3+  
908 SeO3 selenium trioxide seo3  
909 TeO3 Tellurium trioxide teo3  
910 HCO3- bicarbonate anion hco3-  
911 HNO3 Nitric acid hno3  
912 HSO3 Hydroxysulfonyl radical hso3  
913 NH2NO2 nitramide nh2no2  
914 C2H2CO cyclopropenone c2h2co  
915 C3H2O Propadienal c3h2o  
916 HCCCHO 2-propynal hcccho  
917 C2H2O2 Ethanedial c2h2o2  
918 C2H2O2+ Ethanedial cation c2h2o2+  
919 H2CO3 Carbonic acid h2co3  
920 H2CS3 thiocarbonic acid h2cs3  
921 H2NO3+ Nitric Acid, Protonated h2no3+  
922 H2SO3 Sulfurous acid h2so3  
923 C2H3NO Nitrosoethylene c2h3no  
924 CH3NCO methylisocyante ch3nco  
925 HOCH2CN cyanomethanol hoch2cn  
926 CH3COO- acetate anion ch3coo-  
927 CH3NO2 Methane, nitro- ch3no2  
928 CH3ONO Methyl nitrite ch3ono  
929 NH2COOH Carbamic acid nh2cooh  
930 H3BO3 Boric acid h3bo3  
931 H3CO3+ carbonic acid, protonated h3co3+  
932 C3H4O 2-Propyn-1-ol c107197  
933 C3H4O allenol c9000071  
934 C3H4O Cyclopropanone cpone  
935 C3H4O Methylketene c6004440  
936 CH2CHCHO Acrolein c3h4o  
937 NH2CONH2 Urea urea  
938 NH2CONH2+ Urea cation urea+  
939 NH2CSNH2 Thiourea thiourea  
940 CH3COOH Acetic acid ch3cooh  
941 CH3OCHO methyl formate ch3ocho  
942 CHOCH2OH hydroxy acetaldehyde haa  
943 NH2COOH2+ Carbamic acid, O-protonated nh2cooh2+  
944 NH3COOH+ protonated Carbamic acid nh3cooh+  
945 H2OHCOOH Water formic acid dimer 1 h2ohcooh_10  
946 H2OHCOOH Water formic acid dimer 2 h2ohcooh_11  
947 HCOOHH2O Formic acid water dimer hcoohh2o  
948 HOCH2OOH hydroxy methyl peroxide hoch2ooh  
949 CH3COCH2 Acetonyl radical ch3coch2  
950 CH2C(OH)NH2 1-amino vinyl alchohol ava  
951 CH3C(OH)=NH Ethaninidic acid eia  
952 CH3CHNOH Acetaldoxime acetaldoxime  
953 CH3CONH2 Acetamide acetamide  
954 HCONHCH3 N-methylformamide nmfa  
955 CH5N2O+ urea, N-protonated ch4n2o+  
956 H2NCOHNH2+ urea, protonated ureah+  
957 C2H5OO ethylperoxy radical c2h5oo  
958 CH3NNCH3 (E)-1,2-Dimethyldiazene dmdiaze  
959 C3H5OH Cyclopropanol cproh  
960 C3H6O 2-Propen-1-ol c107186  
961 C3H6O Acetone enol enol  
962 C3H6O Oxetane oxetane  
963 C3H6O Propylene oxide prox  
964 CH3CH2CHO Propanal propanal  
965 CH3COCH3 Acetone acetone  
966 CH3COCH3- acetone anion ch3coch3-  
967 C3H6S Thietane thietane  
968 C3H6S Thiirane, methyl- methiirane  
969 CH3CSCH3 Thioacetone ch3csch3  
970 C2H6O2 1,2-Ethanediol ethdiol  
971 CH3SOCH3 Dimethyl sulfoxide dmso  
972 CH2SHCH2SH 1,2-Ethanedithiol ethdisl  
973 CH3SSCH3 Disulfide, dimethyl ch3ssch3  
974 CH3COHCH3+ acetone, protonated acetoneh+  
975 HOCH2CH2NH2 monoethanolamine mea  
976 C3H7OH 1-Propanol proh  
977 CH3CHOHCH3 Isopropyl alcohol isoproh  
978 CH3OC2H5 Ethane, methoxy- etome  
979 C3H7SH 1-Propanethiol prsh  
980 CH3CHSHCH3 2-Propanethiol isoprsh  
981 CH3SCH2CH3 Ethane, (methylthio)- etsme  
982 H2OCH3OCH3 water dimethylether dimer h2och3och3  
983 Li2F2 Lithium fluoride dimer li2f2  
984 Na2F2 Sodium Fluoride Dimer na2f2  
985 Na2Cl2 Disodium dichloride na2cl2  
986 C2Cl2 dichloroacetylene c2cl2  
987 C2Cl2+ dichloroacetylene cation c2cl2+  
988 FNO2 Nitryl fluoride fno2  
989 FONO Nitrosyl hypofluorite fono  
990 ClNO2 Nitryl chloride clno2  
991 ClONO chlorine nitrite clono  
992 BrONO Bromine nitrite brono  
993 CF2O+ Carbonic difluoride cation f2co+  
994 COFCl Carbonic chloride fluoride cofcl  
995 CCl2O Phosgene cl2co  
996 Cl2CS Thiophosgene cl2cs  
997 COBr2 Carbonic dibromide cobr2  
998 BF3- Borane, trifluoro- anion bf3-  
999 BF3+ boron trifluoride cation bf3+  
1000 BClF2 Chlorodifluoroborane bclf2  
1001 AlF2Cl Aluminum chloride difluoride alclf2  
1002 ScF3 Scandium trifluoride ScF3  
1003 AlFCl2 Aluminum dichloride fluoride alcl2f  
1004 BCl3 Borane, trichloro- bcl3  
1005 BCl3+ Boron Trichloride cation bcl3+  
1006 GaF3 Gallium trifluoride gaf3  
1007 AlCl3 Aluminum trichloride alcl3  
1008 GaCl3 Gallium trichloride gacl3  
1009 BBr3 Boron tribromide bbr3  
1010 AlBr3 Aluminum Bromide albr3  
1011 ClO3 Chlorine trioxide clo3  
1012 ClO3- chlorate anion clo3-  
1013 BrO3- Bromate anion bro3-  
1014 CF3 Trifluoromethyl radical cf3  
1015 CF2Cl difluorochloromethyl radical cf2cl  
1016 SiF3+ Silicon trifluoride cation sif3+  
1017 CFCl2 dichlorofluoromethyl radical cfcl2  
1018 CCl3 Trichloromethyl radical ccl3  
1019 CCl3- Trichloromethyl anion ccl3-  
1020 CCl3+ Trichloromethyl cation ccl3+  
1021 SiCl3 trichlorosilyl radical sicl3  
1022 SiCl3+ trichlorosilyl cation sicl3+  
1023 CBr3 tribromomethyl radical cbr3  
1024 FOOF Perfluoroperoxide foof  
1025 ClOOCl Dichlorine dioxide cloocl  
1026 FSSF Difluorodisulfane fssf  
1027 S2F2 Thio-thionyl fluoride s2f2  
1028 SOCl2 thionyl chloride socl2  
1029 SeOCl2 selenium oxychloride seocl2  
1030 NF3 Nitrogen trifluoride nf3  
1031 PF3 Phosphorus trifluoride pf3  
1032 NCl3 nitrogen trichloride ncl3  
1033 AsF3 Arsenic trifluoride asf3  
1034 PCl3 Phosphorus trichloride pcl3  
1035 SbF3 Antimony Trifluoride sbf3  
1036 AsCl3 Arsenous trichloride ascl3  
1037 SbCl3 Antimony Trichloride sbcl3  
1038 NBr3 Nitrogen Tribromide nbr3  
1039 PBr3 Phosphorus tribromide pbr3  
1040 AsBr3 Arsenic tribromide asbr3  
1041 NI3 Nitrogen triiodide ni3  
1042 PI3 Phosphorus triiodide pi3  
1043 ClSSCl Disulfur dichloride s2cl2  
1044 BrF3 Bromine trifluoride brf3  
1045 IF3 iodone trifluoride if3  
1046 CHF3 Methane, trifluoro- chf3  
1047 CHF2Cl difluorochloromethane chf2cl  
1048 SiHF3 trifluorosilane sihf3  
1049 CHFCl2 fluorodichloromethane chfcl2  
1050 CDCl3 trichloromethane-d cdcl3  
1051 CHCl3 Chloroform chcl3  
1052 CHBrF2 Methane, bromodifluoro- chbrf2  
1053 SiHCl3 Trichlorosilane sihcl3  
1054 CHFClBr fluorochlorobromomethane chfclbr  
1055 CHBrCl2 Methane, bromodichloro- chbrcl2  
1056 CHF2I difluoroiodomethane chf2i  
1057 CHBr2F dibromofluoromethane chbr2f  
1058 CHFClI fluorochloroiodomethane chfcli  
1059 CHCl2I dichloroiodomethane chcl2i  
1060 CHClBr2 Methane, dibromochloro- chclbr2  
1061 CHBr3 bromoform chbr3  
1062 CHI3 Iodoform chi3  
1063 NF3H+ protonated nitrogen trifluoride nf3h+  
1064 AsF3H+ Arsenic trifluoride, protonated asf3h+  
1065 C2H2F2 Ethene, 1,2-difluoro-, (E)- c2h2f2e  
1066 C2H2F2 Ethene, 1,2-difluoro-, (Z)- c2h2f2z  
1067 CH2CF2 Ethene, 1,1-difluoro- ch2cf2  
1068 C2H2ClF 1-chloro-1-fluoroethylene c2h2clf  
1069 CHFCHCl (E)-1-chloro-2-fluoroethene chfchcle  
1070 CHFCHClz (Z)-1-Chloro-2-fluoroethene chfchclz  
1071 CH2CCl2 Ethene, 1,1-dichloro- ch2ccl2  
1072 CHClCHCl Ethene, 1,2-dichloro-, (E)- chclchcle  
1073 CHClCHCl Ethene, 1,2-dichloro-, (Z)- chclchclz  
1074 C2H2Br2 1,1-dibromoethene c2h2br2  
1075 CHBrCHBr Ethene, 1,2-dibromo-, (E)- chbrchbre  
1076 CHBrCHBr Ethene, 1,2-dibromo-, (Z)- chbrchbrz  
1077 CH2FCHO Fluoroacetaldehyde ch2fcho  
1078 CH3COF Acetyl fluoride ch3cof  
1079 CH2ClCHO chloroacetaldehyde ch2clcho  
1080 CH3COCl Acetyl Chloride ch3cocl  
1081 C2H4F2 1,2-difluoroethane c2h4f2  
1082 CH3CHF2 Ethane, 1,1-difluoro- ch3chf2  
1083 CH2FCH2Cl Ethane, 1-chloro-2-fluoro- ch2fch2cl  
1084 CH3CHFCl Ethane, 1-chloro-1-fluoro- ch3chfcl  
1085 CH2ClCH2Cl Ethane, 1,2-dichloro- ch2clch2cl  
1086 CH3CHCl2 Ethane, 1,1-dichloro- ch3chcl2  
1087 CH2BrCH2Cl 1-bromo-2-chloroethane ch2brch2cl  
1088 CH2BrCH2Br Ethane, 1,2-dibromo- ch2brch2br  
1089 CH2CFCH3 2-fluoropropene 2fpro  
1090 CH2CHCH2F Allyl Fluoride allylf  
1091 CH3CHCHF trans-1-Fluoro-1-propene propene1ft  
1092 C3H5Cl 1-Propene, 3-chloro- prop1cl3  
1093 C3H5Cl 1-chloro-1-propene(E) prop1cl1e  
1094 C3H5Cl 1-chloro-1-propene(Z) prop1cl1z  
1095 CH2FCH2OH 2-fluoroethanol ch2fch2oh  
1096 CH2ClCH2OH 2-Chloroethanol ch2clch2oh  
1097 CH2ClCH2OH2+ 2-chloroethanol, protonated ch2clch2oh2+  
1098 CH2FCH2CH3 1-Fluoropropane prf1  
1099 CH3CHFCH3 2-Fluoropropane prf2  
1100 CH2ClCH2CH3 Propane, 1-chloro- prcl1  
1101 CH3CHClCH3 Propane, 2-chloro- prcl2  
1102 CH3CH2CH2Br n-propyl bromide prbr  
1103 CH3CHBrCH3 i-propyl bromide iprbr  
1104 C3H9O+ trimethyl oxonium cation c3h9o+  
1105 B5H9 pentaborane9 b5h9  
1106 C5H4 pentatetraene ptrene  
1107 C5H5 cyclopentadienyl radical c5h5  
1108 C5H5- cylopentadienyl anion c5h5-  
1109 C5H6 1,3-Cyclopentadiene c542927  
1110 C5H6 1-Buten-3-yne, 2-methyl- c78808  
1111 C5H6 3-Penten-1-yne, (E)- c2004695  
1112 C5H6 3-Penten-1-yne, (Z)- c1574409  
1113 C5H6 Bicyclo[2.1.0]pent-2-ene c5164352  
1114 C5H6 Cyclopropylacetylene c6746947  
1115 C5H6 Propellane propellane  
1116 C5H7 1,3-pentadienyl radical pdyl  
1117 C5H7 cyclopentenyl radical cpyl  
1118 C5H8 1,2-Butadiene, 3-methyl- c598254  
1119 C5H8 1,2-Pentadiene c591957  
1120 C5H8 1,3-Butadiene, 2-methyl- c78795  
1121 C5H8 1,3-Pentadiene, (E)- c2004708  
1122 C5H8 1,3-Pentadiene, (Z)- c1574410  
1123 C5H8 1,4-Pentadiene c591935  
1124 C5H8 1-pentyne a1pentyne  
1125 C5H8 2,3-Pentadiene c591968  
1126 C5H8 Bicyclo[1.1.1]pentane bcp  
1127 C5H8 Cyclobutane, methylene- c1120565  
1128 C5H8 Cyclopentene c142290  
1129 C5H8 Ethenylcyclopropane c693867  
1130 CH3CCCH2CH3 2-Pentyne 2pentyne  
1131 C5H10 1-Butene, 2-methyl- c563462  
1132 C5H10 2-Butene, 2-methyl- c513359  
1133 C5H10 2-Pentene, (E)- c646048  
1134 C5H10 2-Pentene, (Z)- c627203  
1135 C5H10 Cyclopentane c287923  
1136 C5H10 Cyclopropane, 1,1-dimethyl- c1630940  
1137 CH2CHCH2CH2CH3 1-pentene pentene  
1138 C5H11 2-Methylbut-2-yl radical c4348350  
1139 C5H12 Butane, 2-methyl- buta2  
1140 C5H12 Pentane pentane  
1141 C5H12 Propane, 2,2-dimethyl- neopentane  
1142 Si(CH3)4 tetramethylsilane tms  
1143 C3H2N2 Malononitrile c3h2n2  
1144 CH2N4 1H-Tetrazole 1htz  
1145 C3H3N2 imidazolyl radical im  
1146 C3H3N2- imidizolyl anion im-  
1147 C2H3N3 1H-1,2,4-Triazole c288880  
1148 C4H4N pyrrolide radical c4h4n  
1149 C4H4N- pyrrolide anion c4h4n-  
1150 C3H4N2 1H-Imidazole 1himidaz  
1151 C3H4N2 1H-Pyrazole 1hpyraz  
1152 C3H4N2 2H-Imidazole imid2h  
1153 C3H4N2 4H-Imidazole imid4h  
1154 C4H5N (E)-2-Butenenitrile c627269  
1155 C4H5N (Z)-2-Butenenitrile c1190767  
1156 C4H5N 2H-pyrrole pyrrole2  
1157 C4H5N 3H-pyrrole pyrrole3  
1158 C4H5N Cyclopropanecarbonitrile c5500210  
1159 C4H5N Pyrrole pyrrole  
1160 CH2CHCH2CN Allylcyanide ch2chch2cn  
1161 C4H6N+ pyrrole, alpha-protonated appyr  
1162 C4H6N+ pyrrole, beta-protonated bppyr  
1163 C4H6N+ pyrrole, protonated ppyr  
1164 C3H6N2 3-Aminopropionitrile c151188  
1165 CH3CH(CH3)CN Propanenitrile, 2-methyl- c4h7n  
1166 CH3CH2CH2CN Butanenitrile c109740  
1167 C5H8 Bicyclo[2.1.0]pentane c185944  
1168 C5H8 Spiropentane c157404  
1169 C4H9N Cyclobutylamine cbam  
1170 C4H9N Pyrrolidine pyrrolidine  
1171 C3H10N2 1,2-Diaminopropane diampr12  
1172 C(CH3)3NH2 2-Propanamine, 2-methyl- c75649  
1173 C(NH2)H2C(CH3)HCH3 1-Propanamine, 2-methyl- c78819  
1174 C(NH2)H2CH2CH2CH3 1-Butanamine butam1  
1175 CH3C(NH2)HCH2CH3 2-Butanamine butam2  
1176 NH(C2H5)2 diethylamine dea  
1177 NC4H12+ tetramethyl ammonium cation nc4h12+  
1178 B2O3 diboron trioxide b2o3  
1179 MgCO3 Magnesium Carbonate mgco3  
1180 BeCO3 Beryllium Carbonate beco3  
1181 CaCO3 Calcium Carbonate caco3  
1182 ONONO Nitrosyl nitrite onono  
1183 PO4--- phosphate po4---  
1184 SO4-- sulfate so4--  
1185 HOONO2 peroxy nitric acid hoono2  
1186 HSO4- bisulfate anion hso4-  
1187 C2H2N2S 1,3,4-Thiadiazole c2h2n2s  
1188 C3H2O2 Propiolic acid c3h2o2  
1189 CHOCOOH oxo acetic acid oaa  
1190 CHOOCHO diformyl ether choocho  
1191 H2SO4 Sulfuric acid h2so4  
1192 H2SeO4 Selenic acid h2seo4  
1193 C3H3NO Isoxazole isox  
1194 C3H3NO Oxazole oxazole  
1195 C3H3NS Thiazole thiazole  
1196 CH3C(O)OO acetyl peroxy radical ch3coo2  
1197 CH3NO3 Methyl nitrate ch3no3  
1198 H3PO4 Phosphoric Acid h3po4  
1199 C4H4O Furan furan  
1200 C4H4O+ Furan cation furan+  
1201 CH3COCCH 3-butyn-2-one c1423605  
1202 C4H4S Thiophene furans  
1203 C4H4Se selenophene c4h4se  
1204 C3H4O2 β–Propiolactone beta  
1205 C3H4O2 2-Propenoic acid propenoic2  
1206 C3H4O2 Methyl glyoxal megly  
1207 C3H4O2 propanedial propanedial  
1208 C3H4O2 propenalol propenalol  
1209 HOCHCCHOH allenediol aldiol  
1210 C2H4O3 1,2,3-trioxolane c2h4o3  
1211 C2H4O3 trioxolane124 triox  
1212 HOCH2COOH Hydroxyacetic acid hac  
1213 CH2CHCONH2 Acrylamide c79061  
1214 CH3OCH2CN Methoxyacetonitrile c1738369  
1215 CH5N3S Hydrazinecarbothioamide c79196  
1216 H2NCH2COOH Glycine glycine  
1217 CH3SO2NH2 methanesulfonamide ch3so2nh2  
1218 C4H6O cis-2-butenal butenal2c  
1219 C4H6O Cyclobutanone cbutone  
1220 C4H6O Furan, 2,3-dihydro- furan23h  
1221 C4H6O Furan, 2,5-dihydro- furan25h  
1222 CH2CHOCHCH2 Vinyl ether vinylether  
1223 CHOCHCHCH3 2-Butenal butenal2  
1224 C4H6S Thiophene, 2,3-dihydro- thiop23h  
1225 C4H6S Thiophene, 2,5-dihydro- thiop25h  
1226 CH2CHSCHCH2 Divinyl sulfide divis  
1227 C2H6N2O Urea, methyl- c598505  
1228 C3H6O2 1,3-Dioxolane dioxolane  
1229 CH3CH2COOH Propanoic Acid propanoic  
1230 CH3COOCH3 methyl acetate aame  
1231 HCOOC2H5 Ethyl formate faee  
1232 CH3SSSCH3 dimethyl trisulfide c2h6s3  
1233 C3H7NO dimethylformamide dmf  
1234 C3H7NO Propanamide propanam  
1235 C2H3OC2H5 Ethene, ethoxy- c109922  
1236 C4H8O Cyclobutanol c2919235  
1237 C4H8O Furan, tetrahydro- thf  
1238 CH2C(CH3)OCH3 1-Propene, 2-methoxy- pre1meo2  
1239 CH3COCH2CH3 2-Butanone buta2one  
1240 CHOCH(CH3)CH3 Propanal, 2-methyl- c78842  
1241 CHOCH2CH2CH3 Butanal butanal  
1242 C4H8S Thiophene, tetrahydro- tht  
1243 C3H8O2 1,3-Propanediol c504632  
1244 C3H8O2 Hydroperoxide, 1-methylethyl c3031752  
1245 C3H8O2 Methane, dimethoxy- c109875  
1246 C3H8O2 Propylene glycol c57556  
1247 C3H8S2 1,3-Propanedithiol c109808  
1248 C4H10O 1-Butanol butanol1  
1249 C4H10O 1-Propanol, 2-methyl- c78831  
1250 C4H10O 2-Butanol, (.+/-.)- butanol2  
1251 C4H10O Ethanol, 1,1-dimethyl- tbuoh  
1252 C4H10O Ethoxy ethane etoet  
1253 C4H10O Methyl propyl ether meopr  
1254 C4H10O Propane, 2-methoxy- c598538  
1255 C4H10O+ 1-Butanol cation butanol1+  
1256 C(CH3)3SH 2-Propanethiol, 2-methyl- tbush  
1257 C2H5SC2H5 Diethyl sulfide etset  
1258 C4H9SH 1-Butanethiol bush  
1259 CH2(SH)CH(CH3)CH3 1-Propanethiol, 2-methyl- c513440  
1260 CH3C(SCH3)HCH3 Propane, 2-(methylthio)- mesipr  
1261 CH3CH(SH)CH2CH3 2-Butanethiol butansl2  
1262 FNO3 Fluorine nitrate fno3  
1263 ClONO2 Chlorine nitrate clono2  
1264 BrONO2 Bromine nitrate brono2  
1265 TiCl4 Titanium tetrachloride ticl4  
1266 ClO4- perchlorate anion clo4-  
1267 BF4- tetrafluoroboron anion bf4-  
1268 ClFO3 Perchloryl fluoride clfo3  
1269 SO2F2 Sulfuryl fluoride so2f2  
1270 SO2Cl2 Sulfuryl chloride so2cl2  
1271 F3NO Nitrogen trifluoride oxide f3no  
1272 F3PO Phosphoryl fluoride pf3o  
1273 Cl3PO Phosphoryl chloride pcl3o  
1274 CF4 Carbon tetrafluoride cf4  
1275 CF3Cl Methane, chlorotrifluoro- cf3cl  
1276 SiF4 Silicon tetrafluoride sif4  
1277 TiF4 Titanium tetrafluoride tif4  
1278 CFCl3 Trichloromonofluoromethane cfcl3  
1279 CF3Br Bromotrifluoromethane cf3br  
1280 GeF4 Germanium tetrafluoride gef4  
1281 CCl4 Carbon tetrachloride ccl4  
1282 CCl4+ Carbon tetrachloride cation ccl4+  
1283 CBrClF2 Methane, bromochlorodifluoro- cbrclf2  
1284 SiCl4 Silane, tetrachloro- sicl4  
1285 CBrCl2F bromodichlorofluoromethane cbrcl2f  
1286 CF3I trifluoroiodomethane cf3i  
1287 CBrCl3 Methane, bromotrichloro- cbrcl3  
1288 CBr2F2 Methane, dibromodifluoro- cbr2f2  
1289 GeCl4 Germanium Tetrachloride gecl4  
1290 CBr2ClF dibromochlorofluoromethane cbr2clf  
1291 CBr2Cl2 dibromodichloromethane cbr2cl2  
1292 CCl3I trichloroiodomethane ccl3i  
1293 CFBr3 fluorotribromomethane cfbr3  
1294 CFClBrI fluorochlorobromoiodomethane cfclbri  
1295 CBr3Cl tribromochloromethane cbr3cl  
1296 CF2I2 difluorodiiodomethane cf2i2  
1297 CBr4 Carbon tetrabromide cbr4  
1298 CCl2I2 dichlorodiiodomethane ccl2i2  
1299 SiBr4 Silicon tetrabromide sibr4  
1300 CBr3I tribromoiododmethane cbr3i  
1301 GeBr4 Germanium tetrabromide gebr4  
1302 CI4 tetraiodomethane ci4  
1303 SiI4 silicon tetraiodide sii4  
1304 ClOF3 Chlorine trifluoride oxide clof3  
1305 SeF4 Selenium tetrafluoride sef4  
1306 SCl4 Sulfur tetrachloride scl4  
1307 C2HF3 Trifluoroethylene c2hf3  
1308 C2HF3+ Trifluoroethylene cation c2hf3+  
1309 CHClCCl2 Trichloroethylene chclccl2  
1310 CHBrCF2 1-Bromo-2,2-difluoroethylene chbrcf2  
1311 HSO3F Fluorosulfonic acid hso3f  
1312 CF3OH trifluoromethanol cf3oh  
1313 CH2ClCCCl 1,3-dichloropropyne ch2clcccl  
1314 CHClCCHCl 1,3-dichloroallene chclcchcl  
1315 CHCl2CCH 3,3-dichloropropyne chcl2cch  
1316 CHCl2CHO dichloroacetaldehyde chcl2cho  
1317 PF3CH2 phosphorane, trifluoromethylene- pf3ch2  
1318 CH3CF3 Ethane, 1,1,1-trifluoro- ch3cf3  
1319 CHF2CH2F Ethane, 1,1,2-trifluoro ch2fchf2  
1320 CH3CF2Cl 1-Chloro-1,1-Difluoroethane ch3cf2cl  
1321 CH3CFCl2 1,1-Dichloro-1-fluoroethane ch3cfcl2  
1322 CH2ClCHCl2 1,1,2-trichloroethane ch2clchcl2  
1323 CH3CCl3 Ethane, 1,1,1-trichloro- ch3ccl3  
1324 SiCl3CH3 methyltrichlorosilane sicl3ch3  
1325 CH3CBr3 1,1,1-tribromoethane ch3cbr3  
1326 NH3BCl3 Amminetrichloroboron nh3bcl3  
1327 CH2CClCHCH2 1,3-Butadiene, 2-chloro- c4h5cl  
1328 C3H5ClO Oxirane, (chloromethyl)- c106898  
1329 CH2FCH2CH2F 1,3-difluoropropane ch2fch2ch2f  
1330 CH3CF2CH3 2,2-difluoropropane ch3cf2ch3  
1331 CH2ClCH2CH2Cl 1,3-dichloropropane prdicl13  
1332 CH2ClCHClCH3 Propane, 1,2-dichloro- prdicl12  
1333 CH3CCl2CH3 Propane, 2,2-dichloro- prdicl22  
1334 CHCl2CH2CH3 1,1-dichloropropane prdicl11  
1335 SiCl2(CH3)2 dichlorodimethylsilane sicl2me2  
1336 CH2CClCH2CH3 1-Butene, 2-chloro- bute1cl2  
1337 CH2CHCH2CH2Cl 1-Butene, 4-chloro- bute1cl4  
1338 CH2CHCHClCH3 1-Butene, 3-chloro- bute1cl3  
1339 CH2ClCHCHCH3 2-Butene, 1-chloro- bute2cl1  
1340 CH3CClCHCH3 2-Butene, 2-chloro-, (E)- bute2cl2e  
1341 CH3CClCHCH3 2-Butene, 2-chloro-, (Z)- bute2cl2z  
1342 CHClCHCH2CH3 (E)-1-Chloro-1-butene bute1cl1  
1343 CHClCHCH2CH3 (Z)-1-Chloro-1-butene bute1cl1z  
1344 C4H9F 1-fluorobutane butaf1  
1345 CH3CHFCH2CH3 2-fluorobutane butaf2  
1346 CH2ClCH2CH2CH3 Butane, 1-chloro- butacl1  
1347 CH3CCl(CH3)CH3 Propane, 2-chloro-2-methyl- procl2me2  
1348 CH3CHClCH2CH3 Butane, 2-chloro- butacl2  
1349 XeF4 Xenon tetrafluoride xef4  
1350 C2H2N2O Furazan furazan  
1351 CF3PH2 phosphine, (trifluoromethyl)- cf3ph2  
1352 NH3BF3 Amminetrifluoroboron nh3bf3  
1353 C6H2 hexatriyne c6h2  
1354 C6H4 (E)-Hexa-1,5-diyne-3-ene c6h4e  
1355 C6H4 (Z)-Hexa-1,5-diyne-3-ene c6h4z  
1356 C6H4 Benzyne benzyne  
1357 C6H5 phenyl phenyl  
1358 C6H5- phenyl anion phenyl-  
1359 C6H6 Prismane prismane  
1360 C6H6 1,2,4,5-Hexatetraene ht1245  
1361 C6H6 2,4-Hexadiyne hexadiyne  
1362 C6H6 3,4-Dimethylenecyclobutene cb34m  
1363 C6H6 Benzene benzene  
1364 C6H6 Benzvalene bv  
1365 C6H6 Dewar Benzene dewar  
1366 C6H6 Hexa-1,5-diene-3-yne hdy153  
1367 C6H6 Trimethylenecycopropane tmcp  
1368 C6H6+ Benzene cation c6h6+  
1369 C6H7+ benzene, protonated c6h7+  
1370 C6H8 (E)-hexa-1,3,5-triene c821078  
1371 C6H8 (E)-hexa-2,3,4-triene c59660650  
1372 C6H8 (Z)-hexa-1,3,5-triene hexatri135  
1373 C6H8 (Z)-hexa-2,3,4-triene hetr234c  
1374 C6H8 1,3-Cyclohexadiene cyhexadiene13  
1375 C6H8 1,4-Cyclohexadiene cyhexadiene14  
1376 C6H8 3-Methylenecyclopentene c930267  
1377 C6H8 Bicyclo[2.1.1]hex-2-ene c822413  
1378 C6H8 Bicyclo[2.2.0]hex-1(4)-ene c30830207  
1379 C6H8 Bicyclo[3.1.0]hex-2-ene c694019  
1380 C6H10 1,3-Hexadiene, (E)- hexdi13e  
1381 C6H10 1,3-Hexadiene, (Z)- hexdi13z  
1382 C6H10 1,4-Hexadiene, (E)- hexdi14t  
1383 C6H10 1,4-Hexadiene, (Z)- hexdi14z  
1384 C6H10 1,5-Hexadiene c592427  
1385 C6H10 1-Butyne, 3,3-dimethyl- c917920  
1386 C6H10 1-Hexyne hexyne1  
1387 C6H10 2,4-Hexadiene, (E,E)- hexdi24ee  
1388 C6H10 2,4-Hexadiene, (E,Z)- hexdi24ez  
1389 C6H10 2,4-Hexadiene, (Z,Z)- hexdi24zz  
1390 C6H10 2-Hexyne c764352  
1391 C6H10 3-Hexyne hexyne3  
1392 C6H10 cyclohexene cyclohexene  
1393 C6H10 Cyclopentene, 1-methyl- c693890  
1394 C6H10 Cyclopentene, 3-methyl- c1120623  
1395 C6H10 Cyclopentene, 4-methyl- c1759815  
1396 C4H6(CH3)2 1,1-dimethylcyclobutane dmcb11  
1397 C6H12 (1R,2R)-1,2-dimethylcyclobutane dmcb12t  
1398 C6H12 (1r,3r)-1,3-dimethylcyclobutane dmcb13t  
1399 C6H12 (E)-2-Hexene e2hexene  
1400 C6H12 (E)-3-methylpent-2-ene c616126  
1401 C6H12 (E)-hex-3-ene e3hexene  
1402 C6H12 (Z)-3-methylpent-2-ene c922623  
1403 C6H12 (Z)-hex-2-ene z2hexene  
1404 C6H12 (Z)-hex-3-ene z3hexene  
1405 C6H12 2,3-dimethylbut-1-ene c563780  
1406 C6H12 2,3-dimethyl-but-2-ene tmeet  
1407 C6H12 3-methylenepentane c760214  
1408 C6H12 cis-1,2-dimethylcyclobutane dmcb12c  
1409 C6H12 cis-1,3-dimethylcyclobutane dmcb13c  
1410 C6H12 Cyclohexane cyclohexane  
1411 C6H12 Cyclopentane, methyl- c96377  
1412 C6H12 Ethylcyclobutane c4806615  
1413 C6H12 hex-1-ene hexene1  
1414 C6H14 Butane, 2,2-dimethyl- buta22  
1415 C6H14 Butane, 2,3-dimethyl- buta23  
1416 C6H14 Hexane hexane  
1417 C6H14 Pentane, 2-methyl- penta2  
1418 C6H14 Pentane, 3-methyl- penta3  
1419 C4N2 2-Butynedinitrile c4n2  
1420 N3P3 1,3,5,2,4,6-Triazatriphosphorine n3p3  
1421 C4H2N2 Fumaronitrile c4h2n2  
1422 C2H2N4 sym-tetrazine ttz  
1423 C3H3N3 1,3,5-Triazine triazine135  
1424 CH3N5 5-Aminotetrazole c4418615  
1425 C4H4N2 1,3-Diazine diazine13  
1426 C4H4N2 Pyrazine pyrazine  
1427 C4H4N2 Pyridazine pyridazine  
1428 C4H4N2 Succinonitrile c110612  
1429 C2H4N4 1H-Tetrazole, 1-methyl- c16681779  
1430 C2H4N4 1H-Tetrazole, 5-methyl- c4076362  
1431 C2H4N4 2H-Tetrazole, 2-methyl- c16681780  
1432 C5H5N Bicyclo[1.1.0]butane-1-carbonitrile bibucn  
1433 C5H5N E-2,4-pentadienenitrile bdcn  
1434 C5H5N Pyridine pyridine  
1435 B3N3H6 borazine borazine  
1436 C6H6 Fulvene fulvene  
1437 C5H6N+ Pyridinium c5h6n  
1438 C4H6N2 1H-Imidazole, 2-methyl- c693981  
1439 C5H7N (E)-2-Pentenenitrile c26294984  
1440 C5H7N (E)-3-Pentenenitrile c16529661  
1441 C5H7N (Z)-2-Pentenenitrile c25899507  
1442 C5H7N 1H-Pyrrole, 1-methyl- c96548  
1443 C5H7N Cyclobutanecarbonitrile c4426113  
1444 C5H9N 1,2,3,6-Tetrahydropyridine c694053  
1445 C5H9N Butanenitrile, 2-methyl- c18936179  
1446 C5H9N Pentanenitrile c110598  
1447 C5H9N Propanenitrile, 2,2-dimethyl- c630182  
1448 C6H10 Bicyclo[3.1.0]hexane c285585  
1449 C5H11N Cyclopentanamine cypentam  
1450 C5H11N Piperidine piper  
1451 C4H12N2 1,2-Butanediamine c4426486  
1452 C4H12N2 2-Methyl-1,2-propanediamine c811938  
1453 Li2CO3 Lithium Carbonate li2co3  
1454 Na2CO3 Sodium Carbonate na2co3  
1455 C2O4-- oxalate anion c2o4  
1456 MgSO4 Magnesium Sulfate mgso4  
1457 N2O4 Dinitrogen tetroxide n2o4  
1458 C3H2O3 vinylene carbonate vica  
1459 C2H2O4 Oxalic Acid oxalic  
1460 C2H3NO3 Oxamic acid oxamic  
1461 C4H4O2 2(5H)-Furanone furanone  
1462 C4H4O2 2-Oxetanone, 4-methylene- c674828  
1463 C2H4N2O2 Oxalamide oxalamide  
1464 C2H4N2S2 Ethanedithioamide c79403  
1465 C2H4CO3 Ethylene carbonate etco3  
1466 C3H4O2S 2H-Thiete-1,1-dioxide c7285327  
1467 C3H4S3 1,3-Dithiolane-2-thione c822388  
1468 C2H4O4 Formic acid dimer fadimer  
1469 C4H5NO 3-Methylisoxazole isox3m  
1470 C4H5NO Isoxazole, 5-methyl- c5765446  
1471 C4H5NS 4-Methylthiazole c693958  
1472 C2H5NO3 Nitric acid, ethyl ester c625581  
1473 C5H6O 2H-Pyran pyran2  
1474 C5H6O 2-methylfuran furan2m  
1475 C5H6O 3-Methylfuran furan3m  
1476 C5H6O Pentadienal pdal  
1477 C5H6S Thiophene, 2-methyl- c554143  
1478 C5H6S Thiophene, 3-methyl- c616444  
1479 C4H6O2 γ–Butyrolactone c96480  
1480 C4H6O2 2,3-Butanedione c431038  
1481 C4H6O2 2-Propenoic acid, methyl ester c96333  
1482 C4H6O2 Crotonic Acid crot  
1483 C4H6OS 2,3-dihydrothiophene-2-ol c9000117  
1484 C4H6OS 2,5-dihydrothiophene-3-ol c9000093  
1485 C4H6OS 4,5-dihydrothiophene-2-ol c9000106  
1486 C4H6OS 4,5-dihydrothiophene-3-ol c9000082  
1487 C4H6OS Dihydro-2-(3H)-thiophenone c1003107  
1488 C4H6OS Dihydro-3-(2H)-thiophenone c1003049  
1489 C4H6OS Vinyl sulfoxide c1115157  
1490 CH6N4S Carbonothioic dihydrazide thiacarb  
1491 C2H6N2O2 (E)-Azodioxymethane c37765154  
1492 C2H6N2O2 Dimethylnitroamine c4164287  
1493 C3H6O3 1,3,5-Trioxane trioxane  
1494 C3H6S3 1,3,5-Trithiane c3h6s3  
1495 C3H6S3 Carbonotrithioic acid, dimethyl ester c2314489  
1496 C2H6O3S Sulfurous acid, dimethyl ester c616422  
1497 C4H7NO 2-Pyrrolidinone c616455  
1498 C4H7NO Ethoxyacetonitrile etoaccn  
1499 C4H7NO Methacrylamide c79390  
1500 C4H7NO Oxazole, 4,5-dihydro-2-methyl- c1120645  
1501 HCONH2CN2H4 formamide aminomethanimine dimer d13  
1502 C3H7ONO Propyl nitrite prono  
1503 CH3CH(CH3)ONO Isopropyl nitrite c541424  
1504 CH3CH(NH2)COOH Alanine alanine  
1505 CH3NHCH2COOH Sarcosine sarcosine  
1506 NH2CH2CH2COOH β–alanine betaalanine  
1507 NH2COOC2H5 Urethane urethane  
1508 C5H8O 2H-Pyran, 3,4-dihydro- c110872  
1509 C5H8O Cyclopentanone c120923  
1510 C5H8O Furan, 2,3-dihydro-5-methyl- c1487156  
1511 C5H8O Methyl cyclopropyl ketone c765435  
1512 N(CH3)2CONH2 Urea, N,N-dimethyl- c598947  
1513 NH(CH3)CONH(CH3) Urea, N,N'-dimethyl- c96311  
1514 NH2CONHC2H5 Urea, ethyl- c625525  
1515 C4H8O2 1,3-Dioxane dioxan13  
1516 C4H8O2 1,3-Dioxolane, 2-methyl- c497267  
1517 C4H8O2 1,4-Dioxane dioxan14  
1518 C4H8O2 Ethene, 1,1-dimethoxy- c922690  
1519 C4H8O2 Ethyl acetate c141786  
1520 C4H8OS s-Ethyl thioacetate c625605  
1521 C3H8O3 1,2,3-Propanetriol glycerin  
1522 C3H8O2S (Methylsulfonyl)ethane c594434  
1523 C4H9NO Butanamide c541355  
1524 C4H9NO Propanamide, 2-methyl- c563837  
1525 C5H10O 2-Butanone, 3-methyl- c563804  
1526 C5H10O 2H-Pyran, tetrahydro- c142687  
1527 C5H10O 2-methylbutyraldehyde 2meba  
1528 C5H10O 2-Pentanone mpk  
1529 C5H10O 3-Pentanone dek  
1530 C5H10O Cyclopentanol c96413  
1531 C5H10O Oxetane, 3,3-dimethyl- c6921353  
1532 C5H10O Pentanal pal  
1533 C5H10S 2H-Thiopyran, tetrahydro- c1613510  
1534 C5H10S 3-Ethylthio-1-propene c5296628  
1535 C5H10S Cyclopentanethiol c1679078  
1536 C5H10S Thiophene, tetrahydro-2-methyl- c1795091  
1537 C5H10S Thiophene, tetrahydro-3-methyl- c4740005  
1538 C4H10O2 1,1-Dimethoxyethane c534156  
1539 C4H10O2 1,3-Butanediol budiol13  
1540 C4H10O2 1,4-Butanediol budiol14  
1541 C4H10O2 Ethane, 1,2-dimethoxy- c110714  
1542 C4H10OS Diethyl sulfoxide c70291  
1543 C4H10S2 1,4-Butanedithiol budisl14  
1544 C4H11NO Diethylhydroxylamine c3710847  
1545 C5H12O 1-Butanol, 2-methyl- c137326  
1546 C5H12O 1-Butanol, 3-methyl- c123513  
1547 C5H12O 1-Pentanol pentanol1  
1548 C5H12O 2-Butanol, 3-methyl- c598754  
1549 C5H12O 2-Pentanol peol2  
1550 C5H12O 3-Pentanol pentan3ol  
1551 C5H12O Butane, 1-methoxy- meobu  
1552 C5H12O Propane, 1-ethoxy- proet  
1553 C5H12O Propane, 2-methoxy-2-methyl- c1634044  
1554 C5H12S 1-Butanethiol, 2-methyl- c1878188  
1555 C5H12S 1-Butanethiol, 3-methyl- c541311  
1556 C5H12S 1-Pentanethiol c110667  
1557 C5H12S 1-Propanethiol, 2,2-dimethyl- c1679089  
1558 C5H12S 2-Butanethiol, 2-methyl- c1679090  
1559 C5H12S 2-Butanethiol, 3-methyl- c2084186  
1560 C5H12S Butane, 1-(methylthio)- c628295  
1561 C5H12S Ethyl propyl sulfide c4110503  
1562 C5H12S Propane, 2-(ethylthio)- c5145993  
1563 C5H12S Propane, 2-methyl-2-(methylthio)- c6163640  
1564 C4F2 difluorobutadiyne c4f2  
1565 ClCOClCO Oxalyl chloride oxcl  
1566 CF3CN Acetonitrile, trifluoro- cf3cn  
1567 CF3CN+ Acetonitrile, trifluoro- cation cf3cn+  
1568 B2F4 Diboron tetrafluoride b2f4  
1569 C2F4 Tetrafluoroethylene c2f4  
1570 C2F4+ Tetrafluoroethylene cation c2f4+  
1571 C2ClF3 Ethene, chlorotrifluoro- c2f3cl  
1572 CF2CCl2 difluorodichloroethylene cf2ccl2  
1573 CFClCClF trans-1,2-dichloro-1,2-difluoroethylene cfclcclf  
1574 CFClCFCl cis-1,2-dichloro-1,2-difluoroethylene cfclcfcl  
1575 C2FCl3 fluorotrichloroethene c2fcl3  
1576 C2Cl4 Tetrachloroethylene c2cl4  
1577 C2Br4 tetrabromoethene c2br4  
1578 CF3OF Trifluoromethylhypofluorite cf3of  
1579 AsF5 Arsenic pentafluoride asf5  
1580 PCl5 Phosphorus pentachloride pcl5  
1581 SF5 Sulfur pentafluoride sf5  
1582 SF5+ pentafluoro sulfur cation sf5+  
1583 SbCl5 Antimony pentachloride sbcl5  
1584 BrF5 bromine pentafluoride brf5  
1585 IF5 pentafluoroiodine if5  
1586 CF3CHO trifluoroacetaldehyde cf3cho  
1587 CCl3CHO trichloroacetaldehyde ccl3cho  
1588 CHFClCHClF ethane, 1,2-dichloro-1,2-difluoro- chfclchclf  
1589 CF3CH2F 1,1,1,2-tetrafluoroethane cf3ch2f  
1590 CHF2CHF2 1,1,2,2-tetrafluoroethane chf2chf2  
1591 CF3CH2Cl 2,2,2-Trifluoroethyl chloride cf3ch2cl  
1592 CHFClCHFCl 1,2-dichloro-1,2-difluoroethane RR chfclchfcl  
1593 CH2ClCCl3 1,1,1,2-tetrachloroethane ch2clccl3  
1594 CH2BrCBr3 1,1,1,2-tetrabromo ethane c2h2br4  
1595 CHCl2CHF2 1,1-dichloro-2,2-difluoroethane c2h2cl2f2  
1596 CF3COOH trifluoroacetic acid cf3cooh  
1597 C4H3ClO Furan, 2-chloro fur2cl  
1598 C4H3ClO Furan,3-chloro fur3cl  
1599 C3H5ClO2 Carbonochloridic acid, ethyl ester c541413  
1600 C3H5Cl3 Propane, 1,2,3-trichloro- prcl135  
1601 C4H8Cl2 1,4-Dichlorobutane c110565  
1602 C4H8Cl2 Butane, 1,2-dichloro- c616217  
1603 C4H8Cl2 Butane, 1,3-dichloro- c1190223  
1604 C4H8Cl2 Butane, 2,3-dichloro-, (r*,r*)-(.+/-.)- c2211678  
1605 C4H8Cl2 Butane, 2,3-dichloro-, (r*,s*)- c4028562  
1606 C4H9ClO 1-Chloro-2-ethoxyethane c628342  
1607 C5H11Cl Pentane, 1-chloro- pencl1  
1608 C4H8O2 Butanoic acid bua  
1609 C6H5CH2 benzyl radical benzyl  
1610 C7H7 cycloheptatrienyl radical c7h7  
1611 C7H7+ cycloheptatrienyl cation c7h7+  
1612 C6H5CH3 toluene toluene  
1613 C7H8 cycloheptatriene cht  
1614 C7H8 Norbornadiene norbor  
1615 C7H8 Quadricyclane qucy  
1616 C7H12 Norbornane nor  
1617 C7H14 cycloheptane c7h14  
1618 C7H16 2-methylhexane 2mhex  
1619 C7H16 3-methylhexane hex3m  
1620 C7H16 heptane heptane  
1621 CH(CN)3 tricyanomethane mecn3  
1622 HN=C=C(CN)2 Dicyanoketenimine c4hn3  
1623 C6H7N 2-Methylpyridine mp  
1624 C6H5NH2 aniline aniline  
1625 C6H13N 2-Methylpiperidine pip2m  
1626 C6H13N cyclohexanamine cham  
1627 C6H15N triethylamine tea  
1628 N2O5 Dinitrogen pentoxide n2o5  
1629 C4H2O3 Maleic Anhydride malan  
1630 C5H4O2 4-Cyclopentene-1,3-dione cpdio  
1631 C5H4O2 furfural furfural  
1632 C6H5O phenoxy radical phenoxy  
1633 C5H5NO 2(1H)-Pyridinone c72762006  
1634 C5H5NO 2(3H)-Pyridinone c9000048  
1635 C5H5NO 2(5H)-Pyridinone c9000037  
1636 C5H5NO 2-Pyridinol c109104  
1637 C5H5NO 3(2H)-Pyridinone c9000004  
1638 C5H5NO 3(4H)-Pyridinone c9000026  
1639 C5H5NO 3(6H)-Pyridinone c9000015  
1640 C5H5NO 3-Pyridinol c109002  
1641 C5H5NO 4(1H)-Pryidinone c9000060  
1642 C5H5NO 4(3H)-Pryidinone c9000059  
1643 C5H5NO 4-Pyridinol c626642  
1644 C6H5OH phenol phenol  
1645 C6H6O 2,4-Cyclohexadienone c24599573  
1646 C6H6O 2,5-Cyclohexadienone c5664335  
1647 C6H5SH Benzenethiol phsh  
1648 HO2CCHNH2CH2OH Serine serine  
1649 C5H8O2 Acetylacetone acac  
1650 C4H8O2S Sulfolane sulfolane  
1651 C7H10 Norbornene norbornene  
1652 CH(C2H3)3 trivinyl methane tvm  
1653 C6H10O cyclohexanone chexo  
1654 C6H12O hexanal c6h12o  
1655 C6H12O Oxepane oxepane  
1656 C3H7OC3H7 di-n-propyl ether propr  
1657 F2CCCF2 tetrafluoroallene pfa  
1658 CF3COO- trifluoro acetate anion cf3coo-  
1659 CF3COF trifluoroacetyl fluoride cf3cof  
1660 CF3COCl trifluoroacetyl chloride cf3cocl  
1661 PF6 Hexafluorophosphate neutral pf6  
1662 SeF6 Selenium hexafluoride sef6  
1663 CF3CHF2 pentafluoroethane cf3chf2  
1664 CF3CHFCl 1,1,1,2-tetrafluorochloroethane cf3chfcl  
1665 CF3CHCl2 1,1-Dichloro-2,2,2-trifluoroethane cf3chcl2  
1666 CHCl2CClF2 Ethane, 1,2,2-trichloro-1,1-difluoro- chcl2cclf2  
1667 CCl3CHCl2 pentachloroethane ccl3chcl2  
1668 C6H5F Fluorobenzene bzf  
1669 C6H5Cl chlorobenzene bzcl  
1670 C6H5Br bromobenzene bzbr  
1671 C8H6 Calicene calicene  
1672 C6H5CCH phenylacetylene phac  
1673 C8H6 benzocyclobutadiene bcbd  
1674 C8H6 Pentalene pentalene  
1675 C6H5CHCH2 Styrene styrene  
1676 C8H8 cubane cubane  
1677 C8H8 cyclooctatetraene cot  
1678 C6H5CH2CH3 Ethylbenzene etbz  
1679 CH3C6H4CH3 meta-xylene mxylene  
1680 CH3C6H4CH3 paraxylene pxylene  
1681 C8H14 Bicyclo[2.2.2]octane bico222  
1682 C8H16 cyclooctane cyclooct  
1683 (CH3)3CC(CH3)3 tetramethylbutane tmb  
1684 C8H18 Octane c8h18  
1685 C6H5CN phenyl cyanide phcn  
1686 C6H12N2 Triethylenediamine ted  
1687 C4O4-- squarate dianion c4o4--  
1688 S4N4 Tetrasulfur tetranitride s4n4  
1689 S8 Octasulfur s8  
1690 C6H4O2 parabenzoquinone pbq  
1691 C4H4N2O2 Uracil uracil  
1692 C6H5CHO benzaldehyde benzal  
1693 C6H5OCH3 Anisole anisole  
1694 C5H9NO2 Proline proline  
1695 C6H12O2 Methyl pivalate c598981  
1696 C6H12O2 Hexanoic acid hexa  
1697 C4F4 tetrafluorcyclobutadiene c4f4  
1698 CF3CF2Cl pentafluorochloroethane cf3cf2cl  
1699 CF2ClCF2Cl 1,2-Dichloro-1,1,2,2-tetrafluoroethane cf2clcf2cl  
1700 CF3CFCl2 1,1-Dichlorotetrafluoroethane cf3cfcl2  
1701 CF2ClCFCl2 Ethane, 1,1,2-trichloro-1,2,2-trifluoro- cf2clcfcl2  
1702 CF3CCl3 1,1,1-trifluoro-2,2,2-trichloroethane cf3ccl3  
1703 C2F6 hexafluoroethane c2f6  
1704 C2Cl6 hexachloroethane c2cl6  
1705 IF7 Iodine heptafluoride if7  
1706 C6H4F2 metadifluorobenzene mdfb  
1707 C6H4F2 orthodifluorobenzene odfb  
1708 C6H4F2 1,4-difluorobenzene pdfb  
1709 C6H4Cl2 1,2-dichlorobenzene dcb12  
1710 C6H4Cl2 1,3-dichlorobenzene dcb13  
1711 C6H4Cl2 1,4-dichlorobenzene dcb14  
1712 C6H5NO nitrosobenzene bzno  
1713 C9H8 Indene indene  
1714 C9H8 spiro[4.4]nona-1,3,6,8-tetraene snt  
1715 C9H12 n-propyl benzene prbz  
1716 C9H20 Nonane nonane  
1717 C(CN)4 tetracyanomethane c5n4  
1718 C5H4N4 purine purine  
1719 C8H7N Indole indole  
1720 C3H3N3O3 cyanuric acid cyanuric  
1721 C6H5NO2 Nitrobenzene c6h5no2  
1722 C6H5COOH benzoic acid benzo  
1723 CH3COC6H5 acetophenone acph  
1724 C3Cl3N3 1,3,5-Triazine, 2,4,6-trichloro- c3cl3n3  
1725 C3F6 hexafluoropropene c3f6  
1726 C6H3F3 Benzene trifluoride 123 bzf3a  
1727 C8H18O 1-Octanol octanol  
1728 C10H8 Azulene azu  
1729 C10H8 naphthalene naph  
1730 C10H10 bullvalene bullv  
1731 C10H16 adamantane adamantane  
1732 C6N4 Tetracyanoethylene tcne  
1733 C6N4- tetracyanoethylene anion tcne-  
1734 C10H22 Decane decane  
1735 C4F6 perfluorobutadiene c4f6  
1736 SF5CF3 Sulfur, pentafluoro(trifluoromethyl)- sf5cf3  
1737 C3F8 perfluoropropane c3f8  
1738 Fe(CO)5 Iron pentacarbonyl ipc  
1739 Fe(C5H5)2 ferrocene fecp2  
1740 B12H12-- Dodecahydrododecaborate(2-) b12h12--  
1741 B12H12-- Dodecahydrododecaborate(2-) b12h12--  
1742 C12H8 Acenaphthylene acenaph  
1743 C12H8 biphenylene biph  
1744 C12H10 biphenyl biphenyl  
1745 C12H10 Heptalene heptalene  
1746 C6H12O6 Inositol inositol  
1747 C6F6 hexafluorobenzene c6f6  
1748 S2F10 disulphur decafluoride s2f10  
1749 C13H10 Fluorene fluorene  
1750 C14H10 Anthracene anth  
1751 C14H10 Phenanthrene phenanthrene  
1752 C14H14 Bibenzyl bibenzyl  
1753 C12H10N2 azobenzene azobenzene  
1754 C6H5COC6H5 benzophenone benzophenone  
1755 C16H10 Pyrene pyrene  
1756 C18H12 Tetracene tetracene  
1757 C19H16 Triphenylmethane tpm  
1758 C24H12 Coronene coronene  
1759 C60 Buckminsterfullerene c60