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List of which calculations are completed at ROHF /6-31G*

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count Species Name State Conformation
1 D Deuterium atom 1SKh
2 H Hydrogen atom 1SKh
3 H- Hydrogen atom anion 2SKh
4 H+ Hydrogen atom cation  Kh
5 H2- hydrogen diatomic anion 2Σu+D∞h
6 H2+ Hydrogen cation 2Σg+D∞h
7 He Helium atom   
8 He- Helium atom anion 2SKh
9 He+ Helium atom cation 2SKh
10 HeH+ Helium hydride cation 1ΣC∞v
11 He2+ helium diatomic cation 2ΣuD∞h
12 Li Lithium atom 2SKh
13 Li+ Lithium atom cation 1SKh
14 Na Sodium atom 2SKh
15 Na- Sodium atom anion 1SKh
16 K Potassium atom 2SKh
17 K- Potassium atom anion 1SKh
18 K+ Potassium atom cation 1SKh
19 Cu Copper atom 2SKh
20 Cu- Copper atom anion 1SKh
21 Cu+ Copper atom cation 1SKh
22 LiH- lithium hydride anion 2ΣC∞v
23 LiH+ lithium hydride cation 2ΣC∞v
24 NaH+ sodium hydride cation 2ΣC∞v
25 KH Potassium hydride 1ΣC∞v
26 KH+ Potassium hydrogen cation 2ΣC∞v
27 CuH Copper monohydride 1ΣC∞v
28 Be+ Beryllium atom cation 2SKh
29 Mg- Magnesium atom anion 2PKh
30 Mg+ Magnesium atom cation 2SKh
31 Ca- Calcium atom anion 2DKh
32 Ca+ Calcium atom cation 2SKh
33 BeH beryllium monohydride 2ΣC∞v
34 MgH magnesium monohydride 2ΣC∞v
35 CaH Calcium monohydride 2ΣC∞v
36 TiH Titanium monohydride 4ΦC∞v
37 ZnH Zinc monohydride 2ΣC∞v
38 BeH2+ Beryllium dihydride cation 2ΣC∞v
39 BeH2+ Beryllium dihydride cation 2ΣuD∞h
40 BeH2+ Beryllium dihydride cation   
41 B Boron atom 2PKh
42 B Boron atom 4PKh
43 B+ Boron atom cation 1SKh
44 Al Aluminum atom 2PKh
45 Al- Aluminum atom anion 3PKh
46 Al+ Aluminum atom cation 1SKh
47 Sc Scandium atom 2DKh
48 Sc+ Scandium cation 3DKh
49 Ga Gallium atom 2P 
50 Ga- Gallium atom anion 3POh
51 Ga+ Gallium atom cation 1S 
52 BH Boron monohydride 3ΠC∞v
53 BH- boron monohydride anion 2ΠC∞v
54 BH- boron monohydride anion 4ΣC∞v
55 AlH- aluminum monohydride anion 2ΠC∞v
56 AlH+ aluminum monohydride cation 2ΣC∞v
57 ScH+ Scandium monohydride cation 2ΣC∞v
58 GaH+ Gallium monohydride cation 2ΣC∞v
59 BH2 boron dihydride 2A1C2v
60 BH2- boron dihydride anion 3B1C2v
61 AlH2 aluminum dihydride 2A1C2v
62 AlH2- aluminum dihydride anion 1A1C2v
63 AlH2+ aluminum dihydride cation 1ΣgD∞h
64 BH3+ boron trihydride cation 2E'D3h
65 BH3+ boron trihydride cation 2B2C2v
66 BH3+ boron trihydride cation  C2v
67 AlH3- aluminum trihydride anion 2A2"D3h
68 AlH3- aluminum trihydride anion  C3v
69 AlH3+ aluminum trihydride cation 2ED3h
70 AlH3+ aluminum trihydride cation 2A1C2v
71 BH4 borohydride 2B2C2v
72 BH4- borohydride anion 1A1Td
73 C Carbon atom 3P0Kh
74 C- Carbon atom anion 2DKh
75 C+ Carbon atom cation 2PKh
76 Si Silicon atom 3PKh
77 Si- Silicon atom anion 4SKh
78 Si+ Silicon atom cation 2PKh
79 Ge Germanium atom 3PKh
80 Ge- Germanium anion 4SKh
81 Ge+ Germanium cation 2PKh
82 CH Methylidyne 2Π1/2C∞v
83 SiH Silylidyne 2ΠC∞v
84 SiH- silicon monohydride anion 3ΣC∞v
85 GeH germylidene 2ΠC∞v
86 CH2 Methylene 3B1C2v
87 CH2 Methylene 3ΣGD∞h
88 CH2- methylene anion 2B1C2v
89 CH2+ methylene cation 2A1C2v
90 CH2+ methylene cation 2ΠD∞h
91 SiH2 silicon dihydride 3B1C2v
92 SiH2- silicon dihydride anion 2B1C2v
93 SiH2+ silicon dihydride cation 2A1C2v
94 GeH2 germylene 1A1C2v
95 GeH2- germylene anion 2B1C2v
96 CH3 Methyl radical 2A1D3h
97 CH3- methyl anion 1A1C3v
98 CH3+ methyl cation 1A1'D3h
99 SiH3 Silyl radical 2A1C3v
100 SiH3- Silyl anion 1A1C3v
101 SiH3+ Silyl cation 1A1'D3h
102 GeH3 Germyl radical 2A1C3v
103 GeH3+ germyl cation 1A1'D3h
104 N Nitrogen atom 4SKh
105 N- Nitrogen atom anion 3SKh
106 N+ Nitrogen atom cation 3PKh
107 P Phosphorus atom 4SKh
108 P- Phosphorus atom anion 3PKh
109 P+ Phosphorus atom cation 3PKh
110 V Vanadium atom 4FKh
111 V+ Vanadium atom cation 5DKh
112 As Arsenic atomic 4SKh
113 As- Arsenic anion 3PKh
114 As+ Arsenic cation 3PKh
115 NH Imidogen 3Σ-C∞v
116 NH- Imidogen anion 2ΠC∞v
117 NH+ imidogen cation 2ΠC∞v
118 PH phosphorus monohydride 3Σ-C∞v
119 AsH Arsenic monohydride 3ΣC∞v
120 AsH+ Arsenic monohydride cation 2ΠC∞v
121 ND2 Amidogen-d2 2B1C2v
122 NH2 Amino radical 2B1C2v
123 NH2+ Amino cation 3B1C2v
124 PH2 Phosphino radical 2B1C2v
125 PH2- Phosphino anion 1A1C2v
126 PH2+ Phosphino cation 1A1C2v
127 AsH2 Arsenic dihydride 2A1C2v
128 NH3- Ammonia anion 2A1C3v
129 NH3+ ammonia cation 2A2"D3h
130 PH3+ Phosphine cation 2A1C3v
131 AsH3+ Arsine cation 2A1C3v
132 NH4 Ammonium radical   
133 PH4 Phosphoranyl radical   
134 O Oxygen atom 3SKh
135 O- Oxygen atom anion 2PKh
136 O+ Oxygen atom cation 4SKh
137 S Sulfur atom 3PKh
138 S- Sulfur atom anion 2PKh
139 S+ Sulfur atom cation 4SKh
140 Se Selenium atom 3PKh
141 Se- Selenium atom anion 2PKh
142 Se+ Selenium atom cation 4SKh
143 DO Hydroxyl-d 2ΠC∞v
144 OH Hydroxyl radical 2ΠC∞v
145 OH+ hydoxyl cation 3ΣC∞v
146 DS Mercapto-d 2ΠC∞v
147 HS Mercapto radical 2ΠC∞v
148 HS- mercapto anion 1ΣC∞v
149 HS+ sulfur monohydride cation 3ΣC∞v
150 CrH Chromium hydride 6ΣC∞v
151 CrH+ Chromium hydride cation 5ΣC∞v
152 HSe Selenium monohydride 2ΠC∞v
153 HSe+ selenium monohydride cation 3ΣC∞v
154 H2O- water anion 2A1C2v
155 H2O- water anion 2A'Cs
156 H2O+ water cation 2B1C2v
157 H2S- Hydrogen sulfide anion 2A'Cs
158 H2S+ Hydrogen sulfide cation 2B1C2v
159 H2Se Hydrogen selenide 1A1C2v
160 H2Se+ Hydrogen selenide cation 2B1C2v
161 H3S+ Sulfonium cation 1A1C3v
162 F Fluorine atom 2PKh
163 F- Fluorine atom anion 1SKh
164 F+ Fluorine atom cation 3SKh
165 F+ Fluorine atom cation 1DKh
166 Cl Chlorine atom 2PKh
167 Cl- Chlorine atom anion 1SKh
168 Cl+ Chlorine atom cation 3PKh
169 Cl+ Chlorine atom cation 1DKh
170 Br Bromine atom 2PKh
171 Br- Bromine atom anion 1SKh
172 Br+ Bromine atom cation 3PKh
173 HF- hydrogen fluoride anion 2ΣC∞v
174 HF+ hydrogen fluoride cation 2ΠC∞v
175 HCl- hydrogen chloride anion 2ΣC∞v
176 HCl+ hydrogen chloride cation 2ΠC∞v
177 HBr hydrogen bromide 1ΣC∞v
178 HBr- hydrogen bromide anion 2ΣC∞v
179 HBr+ hydrogen bromide cation 2ΠC∞v
180 H2Cl+ dihydrogen monochloride cation 1A1C2v
181 Ne Neon atom   
182 Ne- Neon atom anion 2SKh
183 Ne+ Neon atom cation 2PKh
184 Ar- Argon atom anion 2SKh
185 Ar+ Argon atom cation 2PKh
186 Kr+ Krypton cation 2PKh
187 NeH neon hydrogen 2ΣC∞v
188 ArH+ Argon hydride cation 1ΣC∞v
189 Li2- lithium diatomic anion 2ΣuD∞h
190 Li2+ lithium diatomic cation 2ΣgD∞h
191 Na2- sodium diatomic anion 2ΣuD∞h
192 Na2+ sodium diatomic cation 2ΣgD∞h
193 NaK+ Sodium Potassium diatomic cation 1
194 LiBe Lithium Beryllium 2ΣC∞v
195 LiMg Lithium magnesium 2ΣC∞v
196 NaBe Sodium Beryllium 2ΣC∞v
197 NaMg Sodium Magnesium 2ΣC∞v
198 Be2 Beryllium diatomic 3ΠgD∞h
199 Be2- Beryllium diatomic anion 2ΠuD∞h
200 Be2+ Beryllium diatomic cation 2ΣuD∞h
201 LiB Lithium boride 3ΠC∞v
202 BeB Beryllium monoboride 2ΠC∞v
203 B2 Boron diatomic 3ΣgD∞h
204 B2 Boron diatomic 5ΣuD∞h
205 B2+ Boron diatomic cation 2ΠD∞h
206 BAl Boron Aluminum 3ΣC∞v
207 Al2 Aluminum diatomic 3ΣgD∞h
208 Al2- aluminum diatomic anion 4ΣgD∞h
209 Al2+ aluminum diatomic cation 2ΣgD∞h
210 BGa Boron Gallium 3ΣC∞v
211 AlGa Aluminum Gallium 3ΣC∞v
212 Ga2 Gallium diatomic 3Piu 
213 HBBH Diborane(2) 3ΣGD∞h
214 B2H6+ Diborane cation   
215 LiC Lithium Carbide 4ΣC∞v
216 BeC Beryllium Carbide 3Σ-C∞v
217 BeC Beryllium Carbide   
218 CaC Calcium monocarbide   
219 BC boron monocarbide 4Σ-C∞v
220 BC- boron monocarbide anion 3ΠuC∞v
221 AlC Aluminum carbide 4ΣC∞v
222 BSi Boron silicide 4ΣC∞v
223 BSi Boron silicide 2ΣC∞v
224 C2 Carbon diatomic 3ΠuD∞h
225 C2- carbon diatomic anion 2ΣgD∞h
226 C2+ carbon diatomic cation 4ΣgD∞h
227 SiC silicon monocarbide 3ΣC∞v
228 SiC- silicon monocarbide anion 2ΣgC∞v
229 SiC+ silicon monocarbide cation 2ΠC∞v
230 Si2 Silicon diatomic 3ΣgD∞h
231 GeC Germanium monocarbide 1ΣC∞v
232 SiGe Silicon Germanium   
233 Ge2 Germanium diatomic 3ΣgD∞h
234 Ge2 Germanium diatomic 1ΣGD∞h
235 C2H Ethynyl radical 2ΣC∞v
236 ZnCH2 Zinc methylene 3B1C2v
237 ZnCH2 Zinc methylene 1A'Cs
238 C2H2+ acetylene cation 2ΠuD∞h
239 C2H2+ acetylene cation   
240 CCH2 vinylidene 1A1C2v
241 CCH2 vinylidene 3B2C2v
242 H2CC- vinylidene anion   
243 HCCH- acetylene anion   
244 HCCH- acetylene anion   
245 CH3Li methyl lithium 1A1C3v
246 ZnCH3 Zinc monomethyl 2A1C3v
247 C2H3 vinyl 2A'Cs
248 C2H3+ vinyl cation 1A1C2V bridging H
249 C2H4- Ethylene anion 2B2gD2h
250 C2H4- Ethylene anion 2AgC2h
251 C2H4+ Ethylene cation 2B3uD2h
252 C2H4+ Ethylene cation 2B3D2
253 CH3CH methylmethylene 3A"Cs
254 C2H5 Ethyl radical 2A'Cs
255 C2H6+ ethane cation 2BgC2h
256 C2H6+ ethane cation 2AgCi
257 LiN Lithium Nitride 3ΣC∞v
258 LiN+ Lithium Nitride cation 4ΣC∞v
259 LiP Lithium monophosphide   
260 BeN Beryllium mononitride 4ΣC∞v
261 BeN Beryllium mononitride 2ΠC∞v
262 BeN- Beryllium mononitride anion 1ΣC∞v
263 BeN+ Beryllium mononitride cation 1ΣC∞v
264 MgN Magnesium Nitride   
265 MgN Magnesium Nitride   
266 BN- boron nitride anion 2ΣC∞v
267 AlN- aluminum mononitride anion 2ΣC∞v
268 AlN+ aluminum mononitride cation 2ΠC∞v
269 BP Boron monophosphide 3ΠC∞v
270 AlP Aluminum monophosphide 3ΣC∞v
271 AlP Aluminum monophosphide 3ΠC∞v
272 GaN Gallium mononitride 3ΠC∞v
273 GaP Gallium monophosphide 3ΣC∞v
274 GaAs Gallium arsenide 3Π 
275 GaAs Gallium arsenide 1Σ 
276 BN boron nitride 3ΠC∞v
277 AlN Aluminum nitride 3ΠiC∞v
278 CN Cyano radical 2ΣC∞v
279 CP Carbon monophosphide 2ΣC∞v
280 SiN Silicon nitride 2ΣC∞v
281 SiP Silicon monophosphide 2ΠC∞v
282 SiP- Silicon monophosphide anion 1ΣC∞v
283 SiP+ Silicon monophosphide cation 3ΣC∞v
284 N2 Nitrogen diatomic   
285 N2- nitrogen diatomic anion 2ΠgD∞h
286 N2+ diatomic nitrogen cation 2ΣgD∞h
287 HNB hydrogen nitrogen boron 2ΣC∞v
288 HCN+ hydrogen cyanide cation 2ΠC∞v
289 HNC+ hydrogen isocyanide cation   
290 HCP+ Phosphaethyne cation   
291 NNH Dinitrogen monohydride 2A'Cs
292 HPO+ Hydrogen phosphorus oxide cation 2A'Cs
293 CNH2 Aminomethylidyne radical 2B2C2v
294 H2CN Dihydrogen cyanide radical 2B2C2v
295 H2CN+ hydrocyanonium cation 1A1C2v
296 HCNH methyleneazane 2A'CS cis
297 HCNH methyleneazane 2A'CS trans
298 N2H2+ trans-diazene cation 2AGC2h
299 CH2NH+ Methanimine cation   
300 CHNH2+ Aminocarbene cation   
301 N2H4+ hydrazine cation 2AGC2h
302 CH3NH2+ methyl amine cation 2A'Cs
303 CH3NH3 methyl ammonium radical 2A1C3v
304 LiO lithium oxide 2ΣC∞v
305 LiO- lithium oxide anion 1ΣC∞v
306 LiO- lithium oxide anion 3ΣC∞v
307 LiO+ lithium oxide cation 3ΣC∞v
308 LiS Lithium monosulfide 2ΠC∞v
309 LiS+ Lithium sulfide cation 3ΣC∞v
310 NaO sodium monoxide 2ΣC∞v
311 KO Potassium monoxide 2ΣC∞v
312 KO+ Potassium monoxide cation 3ΣC∞v
313 NaS Sodium sulfide 2ΠC∞v
314 CuO Copper Monoxide 2ΠC∞v
315 LiSe Lithium monoselenide   
316 BeO- Beryllium monoxide anion 2ΣC∞v
317 BeO+ Beryllium monoxide cation 2ΠC∞v
318 BeS+ Beryllium monosulfide cation 2ΠC∞v
319 BO boron monoxide 2ΣC∞v
320 BO- boron monoxide anion 1ΣC∞v
321 AlO Aluminum monoxide 2ΣC∞v
322 BS boron sulfide 2ΣC∞v
323 AlS Aluminum sulfide 2ΣC∞v
324 ScO Scandium monoxide 2ΣC∞v
325 GaO Gallium monoxide 2ΣC∞v
326 GaS Gallium monosulfide   
327 CO Carbon monoxide 3ΠC∞v
328 CO- carbon monoxide anion 2ΠC∞v
329 CO+ carbon monoxide cation 2ΣC∞v
330 TiO Titanium monoxide 3ΔC∞v
331 GeO+ Germanium monoxide cation 2ΣC∞v
332 SiSe+ Silicon Monoselenide cation   
333 NO Nitric oxide 2ΠC∞v
334 NO- nitric oxide anion 3ΣC∞v
335 NS Mononitrogen monosulfide 2ΠC∞v
336 NS- nitrogen sulfide anion 3ΣC∞v
337 PO Phosphorus monoxide 2ΠC∞v
338 PS phosphorus sulfide 2ΣC∞v
339 VO Vanadium monoxide 4Σ- 
340 AsO Arsenic monoxide 2ΠC∞v
341 NSe Nitrogen monoselenide 2ΠC∞v
342 AsS Arsenic monosulfide 2ΠC∞v
343 PSe Phosphorus monoselenide 2ΠC∞v
344 AsSe Arsenic monoselenide 2ΠC∞v
345 O2 Oxygen diatomic 3ΣgD∞h
346 O2- oxygen diatomic anion 2ΠD∞h
347 O2+ diatomic oxygen cation 2ΠgD∞h
348 SO Sulfur monoxide 3ΣC∞v
349 SO Sulfur monoxide 1ΣC∞v
350 SO+ sulfur monoxide cation 2ΠC∞v
351 S2 Sulfur diatomic 3ΣgD∞h
352 SeO Selenium monoxide 3ΣC∞v
353 Se2 Selenium diatomic 3ΣgD∞h
354 BeOH beryllium monohydroxide 2A'Cs
355 BeOH beryllium monohydroxide 2ΣC∞v
356 MgOH magnesium hydroxide 2A'Cs
357 COH Hydroxymethylidyne   
358 HCO Formyl radical 2A'Cs
359 HCO- formyl anion 1A'Cs
360 HCO+ Formyl cation 1ΣC∞v
361 HCS Thioformyl radical 2A'Cs
362 HCS+ Thioformyl cation 1ΣC∞v
363 HNO Nitrosyl hydride 1A'Cs
364 HNO- Nitrosyl hydride anion 2A"Cs
365 HNO+ Nitrosyl hydride cation 2A'Cs
366 NOH Hydroxyimidogen 3A"Cs
367 NOH+ O-protonated nitric oxide 2A'Cs
368 HNS- Sulfur imide anion 2ACs
369 HO2 Hydroperoxy radical 2A"Cs
370 HO2- Hydroperoxy anion 1A'Cs
371 HO2+ Hydroperoxy cation 3A"Cs
372 HO2+ Hydroperoxy cation 1A'Cs
373 SOH Sulfur Hydroxide   
374 SOH+ Sulfur Monoxide, protonated   
375 HS2 Thiosulfeno radical 2A"Cs
376 H2CO- formaldehyde anion 2A'Cs
377 H2CO- formaldehyde anion   
378 H2CO+ formaldehyde cation 2B2C2v
379 H2CS- thioformaldehyde anion   
380 H2CS- thioformaldehyde anion   
381 H2CS+ thioformaldehyde cation 2B2C2v
382 H2NO nitroxide 2B1C2v
383 H2NO nitroxide 2A'Cs
384 H2O2+ Hydrogen peroxide cation 2BgC2h
385 H2O2+ Hydrogen peroxide cation 2A1C2v
386 H2S2+ hydrogen disulfide cation 2BgC2h
387 CH2OH Hydroxymethyl radical 2AC1
388 CH3O Methoxy radical 2A'C1
389 CH3O+ Methoxy cation 3A1C3v
390 CH3S thiomethoxy 2A'C3v
391 NH2OH+ Hydroxylamine cation   
392 CH3OH- Methyl alcohol anion 2A'Cs
393 CH3OH- Methyl alcohol anion 2A'CS eclipsed
394 CH3OH+ Methyl alcohol cation 2A"Cs
395 CH3OH+ Methyl alcohol cation 2AC1
396 CH3SH+ Methanethiol cation 2A"Cs
397 NH2OH2+ protonated hydroxylamine   
398 NH3OH+ N-protonated hydroxylamine   
399 NaF+ sodium fluoride cation 2ΣC∞v
400 LiF- lithium fluoride anion 2ΣC∞v
401 LiF+ lithium fluoride cation 2ΠC∞v
402 BeF Beryllium monofluoride 2ΣC∞v
403 BeF- Beryllium monofluoride anion 1ΣC∞v
404 BeF+ Beryllium monofluoride cation 1ΣC∞v
405 BeCl beryllium monochloride 2ΣC∞v
406 MgF Magnesium monofluoride 2ΣC∞v
407 MgCl magnesium monochloride 2ΣC∞v
408 CaCl calcium monochloride 2ΣC∞v
409 TiCl Titanium Monochloride 4ΣC∞v
410 ZnF Zinc monofluoride 2ΣC∞v
411 ZnCl Zinc monochloride 2ΣC∞v
412 CaBr Calcium monobromide   
413 BCl- boron monochloride anion 2ΠC∞v
414 BCl+ boron monochloride cation 2ΣC∞v
415 AlCl- aluminum monochloride anion 2ΠC∞v
416 AlCl+ aluminum monochloride cation 2ΣC∞v
417 GaF Gallium monofluoride 1ΣC∞v
418 GaF+ Gallium monofluoride cation 2ΣC∞v
419 GaCl Gallium monochloride 1ΣGC∞v
420 GaCl+ Gallium monochloride cation 2ΣC∞v
421 CF Fluoromethylidyne 2ΠC∞v
422 CF- carbon monofluoride anion 3ΣC∞v
423 CCl carbon monochloride 2ΠC∞v
424 SiF silicon monofluoride 2ΠC∞v
425 SiF- silicon monofluoride anion 3ΣC∞v
426 SiCl Clorosilylidyne 2ΠC∞v
427 CBr Carbon monobromide 2ΠC∞v
428 GeF Germanium monofluoride 2ΠC∞v
429 GeCl Germanium monochloride 2ΠC∞v
430 SiBr Silicon monobromide 2ΠC∞v
431 SiBr+ Silicon monobromide cation   
432 NF nitrogen fluoride 3ΣC∞v
433 NF- nitrogen monofluorine anion 2ΠC∞v
434 NF+ nitrogen monofluoirde cation 2ΠC∞v
435 NCl nitrogen monochloride 3ΣC∞v
436 NCl- nitrogen monochloride anion 2ΠC∞v
437 NCl+ nitrogen monochloride cation 2ΠC∞v
438 PF phosphorus monofluoride 3ΣC∞v
439 PCl phosphorus chloride 3ΣC∞v
440 AsF Arsenic monofluoride 3ΣC∞v
441 NBr nitrogen monobromide 3Σ-C∞v
442 AsCl Arsenic monochloride 3ΣC∞v
443 PBr Phosphorus monobromide   
444 FO Oxygen monofluoride 2ΠC∞v
445 ClO Monochlorine monoxide 2ΠC∞v
446 ClO+ chlorine monoxide cation 3ΣC∞v
447 SF Monosulfur monofluoride 2ΠC∞v
448 SF+ sulfur monofluoride cation 3ΣC∞v
449 SCl sulfur monochloride 2ΠC∞v
450 SCl+ sulfur monochloride cation 3ΣgC∞v
451 BrO Bromine monoxide 2ΠC∞v
452 BrO+ Bromine monoxide cation   
453 SeF Selenium monofluoride 2ΠC∞v
454 SBr Sulfur monobromide radical   
455 SBr+ Sulfur monobromide cation   
456 SeCl Selenium monochloride 2ΠC∞v
457 SeBr Selenium monobromide   
458 F2- flourine diatomic anion 2ΣuD∞h
459 F2+ flourine diatomic cation 2ΠgD∞h
460 ClF Chlorine monofluoride 1Σ+C∞v
461 ClF+ clorine monofluoride cation 2ΠC∞v
462 Cl2- chlorine diatomic anion 2ΣuD∞h
463 Cl2+ chlorine diatomic cation 2ΠgD∞h
464 BrCl- bromine chloride anion 2ΣC∞v
465 Br2- bromine diatomic anion 2ΣuD∞h
466 Br2+ bromine diatomic cation 2ΠgD∞h
467 HCF Fluoromethylene 3A"Cs
468 HCCl Chloromethylene 3A"Cs
469 CHBr bromomethylene 3A"Cs
470 HOCl+ hypochlorous acid cation   
471 HOBr+ Hypobromous acid cation 2A"Cs
472 FHF- Hydrogen difluoride anion 1ΣgD∞h
473 CH2Br bromomethyl radical 2A'Cs
474 CH2Br bromomethyl radical   
475 CH2F fluoromethyl radical 2ACs
476 CH2Cl chloromethyl radical 2A'Cs
477 CH2Cl chloromethyl radical 2B1C2v
478 CH3F+ methyl fluoride cation   
479 CH3Cl+ Methyl chloride cation   
480 CH3Br methyl bromide 1A1C3v
481 Ne2+ Neon diatomic cation 2ΣuD∞h
482 Ar2+ Argon diatomic cation 2ΣuD∞h
483 Li3 Lithium trimer 2B2C2v
484 C3 carbon trimer 1A1C2v
485 C3+ carbon trimer cation 2ΣuD∞h
486 C3H3 cyclopropenyl radical 2A'Cs
487 C3H3 Propargyl radical 2B1Cs
488 C3H3- Propargyl anion 1A'Cs
489 C3H3+ Propargyl cation 1A1C2v
490 C3H5 Allyl radical 2A2C2v
491 C3H5 Allyl radical 2A"Cs
492 CH3CHCH 1-propenyl radical 2A'Cs
493 C3H7 n-Propyl radical 2A"C1
494 CH3CHCH3 Isopropyl radical 2AC2
495 LiCN lithium cyanide 1ΣC*V LiCN
496 ZnCN Zinc monocyanide 2ΣC∞v
497 ZnNC Zinc isocyanide 2ΣC∞v
498 CNN Diazocarbene   
499 NCN Cyanoimidogen 3ΣgD∞h
500 N3 azide radical 2ΠgD∞h
501 N3+ azide cation 3ΣgD∞h
502 N3+ azide cation 3ΣC∞v
503 HCCN cyanomethylene 3A"Cs
504 HCCN cyanomethylene 3ΣC∞v
505 HCCN cyanomethylene   
506 HN3 hydrogen azide 1A'Cs
507 HN3+ Hydrazoic acid cation   
508 CH3CN- acetonitrile anion 2EC3v
509 CH3CN- acetonitrile anion 2A'Cs
510 CH3CN+ Acetonitrile cation 2A"Cs
511 HCNCH2+ 2H-Azirine cation   
512 CH2CHNH vinylazine 2A"CS cis
513 CH2CHNH vinylazine 2A"CS trans
514 CH3CHN methylmethaniminyl radical 2A'Cs
515 Li2O+ dilithium oxide cation 2ΠD∞h
516 LiO2 Lithium dioxide   
517 NaO2 Sodium superoxide   
518 CCO Dicarbon monoxide 3ΣC∞v
519 NCO isocyanato radical 2ΠC∞v
520 SCN thiocyanato radical 2ΠC∞v
521 BO2 Boron dioxide 2A'D∞h
522 BO2+ Boron dioxide cation 3ΣgD∞h
523 N2O- Nitrous oxide anion 2A'Cs
524 N2O+ Nitrous oxide cation 2ΠC∞v
525 CO2- Carbon dioxide anion 2A1C2v
526 CO2+ Carbon dioxide cation 2ΠgD∞h
527 CO2+ Carbon dioxide cation 2ΠC∞v
528 OCS+ Carbonyl sulfide cation 2ΠC∞v
529 CS2- Carbon disulfide anion 2A1C2v
530 CS2+ Carbon disulfide cation 2ΠD∞h
531 NO2 Nitrogen dioxide 2A1C2v
532 NO2- Nitrogen dioxide anion 1A1C2v
533 NO2+ Nitrogen dioxide cation 1ΣGD∞h
534 NSO sulfinyl amidogen   
535 PO2 Phosphorus dioxide 2A1C2v
536 PO2+ Phosphorus dioxide cation 1ΣGD∞h
537 SNO Nitrogen oxide sulfide   
538 AsO2 Aresenic dioxide 2A1C2v
539 O3- Ozone anion 2B1C2v
540 O3+ Ozone cation 2A1C2v
541 SO2 Sulfur dioxide 1A1C2v
542 SO2- Sulfur dioxide anion 2B1C2v
543 SO2+ Sulfur dioxide cation 2A1C2v
544 S3- Sulfur trimer anion 2B1C2v
545 S3+ Sulfur trimer cation 2B2C2v
546 SeO2+ Selenium dioxide cation 2A1C2v
547 HCCO ketenyl radical 2ΠC∞v
548 HCCO ketenyl radical 2A"Cs
549 HCOO formate neutral radical 2A'Cs
550 HOCO Hydrocarboxyl radical 1A'cis
551 HOCO Hydrocarboxyl radical 1A'trans
552 HOCO+ Hydrocarboxyl cation 1A'Cs
553 HNO2+ nitrous acid cation 2A'Cs
554 CH2CO+ Ketene cation 2B1C2v
555 CH2CHO Vinyloxy radical 2A"Cs
556 CH3CO Acetyl radical 2A'Cs
557 CH2OOH CH2OOH radical 2AC1
558 CH3OO methylperoxy radical 2A"Cs
559 CH3OO+ methylperoxy cation 1A'Cs
560 C2H4O+ ethylene oxide cation   
561 CH3CHO+ acetaldehyde cation   
562 H2COCH2+ Methyl, (methyleneoxoniumyl)-   
563 CH2CH2OH 2-hydroxy ethyl radical 2A'Cs
564 CH2CH2OH 2-hydroxy ethyl radical 2AC1
565 CH3CH2O Ethoxy radical 2A'Cs
566 CH3CHOH 1-hydroxy-ethyl radical 2AC1
567 CH3OCH2 methoxymethyl radical 2AC1
568 CH3CH2SH ethanethiol 1A'Cs
569 CH3SCH3+ dimethyl sulfide cation   
570 CuF2 Copper difluoride 2ΠgD∞h
571 ZnF2 Zinc difluoride 1ΣGD∞h
572 FCO Carbonyl fluoride 2A'Cs
573 ClCO carbonyl monochloride 2A'Cs
574 BF2 Boron difluoride radical 2A1C2v
575 BrNO Nitrosyl bromide 1A'Cs
576 CF2 Difluoromethylene 3B1C2v
577 CF2- Difluoromethylene anion 2B1C2v
578 CF2+ Difluoromethylene cation 2A1C2v
579 SiF2 Silicon difluoride 1A1C2v
580 SiF2 Silicon difluoride 3B1C2v
581 SiF2+ Silicon difluoride cation 2A1C2v
582 CCl2- dichloromethylene anion 2B1C2v
583 CCl2+ dichloromethylene cation 2A1C2v
584 CBr2 dibromomethylene 3B1C2v
585 FOO Dioxygen monofluoride radical 2A"Cs
586 FOO+ Fluorine dioxide cation   
587 ClOO chloroperoxy radical 2A"Cs
588 ClOO+ chloroperoxy cation 1A'Cs
589 OClO Chlorine dioxide 2B1D∞h
590 OClO- Chlorine dioxide anion 1A'Cs
591 OClO+ Chlorine dioxide cation 1A1C2v
592 ClSO Sulfur chloride oxide 2A"Cs
593 ClS2 Sulfur chloride 2A"Cs
594 BrOO Bromine dioxide   
595 OBrO Bromine dioxide radical 2B1C2v
596 NF2 Difluoroamino radical 2B1C2v
597 NF2+ Difluoroamino cation 1A1C2v
598 PF2 Phosphorus difluoride   
599 SF2- sulfur difluoride anion 2A'Cs
600 SF2- sulfur difluoride anion 2ΠD∞h
601 SF2+ sulfur difluoride cation 2B1C2v
602 BrOCl Bromine hypochlorite 1A'Cs
603 BrOBr Bromine oxide 1A1C2v
604 HCCF+ fluoroacetylene cation 2ΠC∞v
605 HFCO+ formyl fluoride cation 2A'Cs
606 COHCl Formyl chloride 1A'Cs
607 COHBr Formyl bromide 1A'Cs
608 CHCl2 dichloromethyl radical 2B1C2v
609 CHCl2 dichloromethyl radical 2A'Cs
610 CHF2 difluoromethyl radical 2ACs
611 CHFCl Chlorofluoromethyl radical   
612 CHBr2 dibromomethyl radical   
613 CH2CHF Ethene, fluoro- 1A'Cs
614 CH3OCl methyl hypochlorite 1A'Cs
615 CH2CH2Cl 2-chloroethyl radical 2A'Cs
616 CHClCH3 1-chloroethyl radical 2AC1
617 C4 Carbon tetramer 3ΣgD∞h
618 C4H2+ diacetlyene cation 2ΠgD∞h
619 CH3CHCHCH2 methylallyl radical 2A"Cs
620 C(CH3)3 Tert-butyl radical 2A"C3v
621 CH2CH(CH3)2 Isobutyl radical 2A'C1
622 CH3CHCH2CH3 2-Butyl radical 1AC1
623 C2N2+ Cyanogen cation 2ΠgD∞h
624 HCCCN+ Cyanoacetylene cation 2ΠC∞v
625 C3H3N+ acrylonitrile cation 2A"Cs
626 NO3 Nitrogen trioxide 2B2one long, two short
627 NO3+ nitrogen trioxide cation 1A1C2v
628 NO3+ nitrogen trioxide cation 1A1'D3h
629 SO3- Sulfur trioxide anion 2A1pyramidal
630 SO3- Sulfur trioxide anion 2A2"planar
631 SO3+ Sulfur trioxide cation 2A2'D3h
632 HSO3 Hydroxysulfonyl radical 2AC1
633 C2H2O2 Ethanedial 1AgC2h
634 CH3COCH2 Acetonyl radical 2A"Cs
635 C2H5OO ethylperoxy radical 2A'Cs
636 CH3COCH3- acetone anion 2A'Cs
637 C2Cl2+ dichloroacetylene cation 2ΠUD∞h
638 BrONO Bromine nitrite 1A'CS trans
639 CF2O+ Carbonic difluoride cation   
640 COFCl Carbonic chloride fluoride 1A'Cs
641 COBr2 Carbonic dibromide 1A1C2v
642 BF3- Borane, trifluoro- anion 2A1D3h
643 BF3- Borane, trifluoro- anion 2A1C3v
644 BF3+ boron trifluoride cation 2A2'D3h
645 BF3+ boron trifluoride cation 2B2C2v
646 BF3+ boron trifluoride cation   
647 BCl3+ Boron Trichloride cation   
648 CF3 Trifluoromethyl radical 2A1C3v
649 CF3- Trifluoromethyl anion 1A1C3v
650 CF3+ Trifluoromethyl cation 1A1'D3h
651 CF2Cl difluorochloromethyl radical   
652 SiF3 Silicon trifluoride radical 2A1C3v
653 SiF3+ Silicon trifluoride cation 1A1'D3h
654 CFCl2 dichlorofluoromethyl radical   
655 CCl3 Trichloromethyl radical 2A1C3
656 CCl3- Trichloromethyl anion 1A1C3v
657 CCl3+ Trichloromethyl cation 1A1'D3h
658 CBr3 tribromomethyl radical   
659 NF3 Nitrogen trifluoride 1A1C3v
660 NF3- Nitrogen trifluoride anion 2A1C3v
661 NF3- Nitrogen trifluoride anion 2ACs
662 NF3+ Nitrogen trifluoride cation 2A1C3v
663 SF3 Sulfur trifluoride 2A'Cs
664 CHBrF2 Methane, bromodifluoro- 1A'Cs
665 CHBrCl2 Methane, bromodichloro- 1A'Cs
666 CHClBr2 Methane, dibromochloro- 1A'Cs
667 CH2ClCHO chloroacetaldehyde 1AC1 bisecting, trans
668 CH2BrCH2Br Ethane, 1,2-dibromo- 1AgC2h
669 CH3CH2CH2Br n-propyl bromide 1A'Cs
670 CH3CHBrCH3 i-propyl bromide 1A'Cs
671 C5H5 cyclopentadienyl radical 2B1C2v
672 C5H7 cyclopentenyl radical 2A2C2v
673 C5H11 2-Methylbut-2-yl radical 1AC1
674 C3H3N2 imidazolyl radical 2B1C2v
675 C4H4N pyrrolide radical 2A2C2v
676 C3O2+ Carbon suboxide cation 2ΠUD∞h
677 CBrClF2 Methane, bromochlorodifluoro- 1A'Cs
678 CBr4 Carbon tetrabromide 1A1Td
679 C2HF3+ Trifluoroethylene cation 2A"Cs
680 CHCl2CHO dichloroacetaldehyde 1AC1
681 CH3CF2Cl 1-Chloro-1,1-Difluoroethane 1A'Cs
682 C6H5 phenyl 2A1C2v
683 SF5 Sulfur pentafluoride 2A1C4v
684 CF3CHO trifluoroacetaldehyde 1A'Cs
685 CCl3CHO trichloroacetaldehyde 1A'Cs
686 CF3CH2Cl 2,2,2-Trifluoroethyl chloride 1A'Cs
687 C6H5CH2 benzyl radical 2B1Cs
688 C7H7 cycloheptatrienyl radical 2A2C2v
689 C6H13N cyclohexanamine 1AC1
690 C6H5O phenoxy radical 2B1C2v
691 PF6 Hexafluorophosphate neutral 2B2C2v
692 C6H12O2 Methyl pivalate 1AC1
693 C6H12O2 Hexanoic acid 1A1Cs
694 CF3CF2Cl pentafluorochloroethane 1A'Cs
695 CF2ClCF2Cl 1,2-Dichloro-1,1,2,2-tetrafluoroethane 1AgC2h

Species NOT done yet
count Species Name file name problem
1 D- Deuterium atom anion d-  
2 D+ Deuterium atom cation d+  
3 D2 Deuterium diatomic d2  
4 H2 Hydrogen diatomic h2  
5 HD Deuterium hydride hd  
6 H3+ hydrogen trimer cation h3+  
7 He Helium atom he  
8 HeH Helium hydride heh  
9 Li- Lithium atom anion li-  
10 Na+ Sodium atom cation na+  
11 LiH Lithium Hydride lih  
12 NaH sodium hydride nah  
13 NaH- sodium hydride anion nah-  
14 Be Beryllium atom be  
15 Be- Beryllium atom anion be-  
16 Mg Magnesium atom mg  
17 Ca Calcium atom ca  
18 Zn Zinc atom zn  
19 Zn- Zinc atom anion zn-  
20 Zn+ Zinc atom cation zn+  
21 BeH- berylium monohydride anion beh-  
22 BeH+ beryllium monohydride cation beh+  
23 MgH- magnesium monohydride anion mgh-  
24 MgH+ magnesium monohydride cation mgh+  
25 CaH+ Calcium monohydride cation cah+  
26 ZnH+ Zinc, protonated znh+  
27 BeH2 beryllium dihydride beh2  
28 MgH2 magnesium dihydride mgh2  
29 CaH2 Calcium Hydride cah2  
30 ZnH2 Zinc hydride znh2  
31 B- Boron atom anion b-  
32 BH Boron monohydride bh  
33 BH+ boron monohydride cation bh+  
34 AlH aluminum monohydride alh  
35 ScH Scandium monohydride sch  
36 GaH Gallium monohydride gah  
37 BH2+ Boron dihydride cation bh2+  
38 BH3 boron trihydride bh3  
39 BH3- boron trihydride anion bh3-  
40 AlH3 aluminum trihydride alh3  
41 ScH3 Scandium trihydride sch3  
42 GaH3 Gallium trihydride gah3  
43 AlH4- Aluminum tetrahydride anion alh4-  
44 C- Carbon atom anion c-  
45 Ti Titanium atom ti  
46 Ti- Titanium atom anion ti-  
47 Ti+ Titanium atom cation ti+  
48 Sn Tin atom sn  
49 Sn+ Tin cation sn+  
50 CH- methylidyne anion ch-  
51 CH+ Methylidyne cation ch+  
52 SiH+ silicon monohydride cation sih+  
53 GeH+ Germaniun monohyrdide cation geh+  
54 CD4 methane-d4 cd4  
55 CH2D2 methane-d2 ch2d2  
56 CH3D methane-d ch3d  
57 CH4 Methane ch4  
58 CH4- Methane anion ch4-  
59 CH4+ Methane cation ch4+  
60 CHD3 methane-d3 chd3  
61 SiH2D2 silane-d2 sih2d2  
62 SiH4 Silane sih4  
63 GeH4 Germane geh4  
64 SnH4 Stannane snh4  
65 SiH5+ Silane, protonated sih5+  
66 Sb Antimony atom sb  
67 PH+ phosphorus monohydride cation ph+  
68 SbH Antimony monohydride sbh  
69 NH2- amino anion nh2-  
70 AsH2+ Arsenic dihydride cation ash2+  
71 ND3 Ammonia-d3 nd3  
72 NH3 Ammonia nh3  
73 PH3 Phosphine ph3  
74 AsH3 Arsine ash3  
75 SbH3 Stibine sbh3  
76 AsH4+ Arsonium ash4+  
77 NH4+ ammonium cation nh4+  
78 PH4+ phosphonium cation ph4+  
79 Cr Chromium atom cr  
80 Te Tellurium atom te  
81 Te+ Tellurium atom cation te+  
82 OH- hydroxide anion oh-  
83 HSe- selenium monohydride anion hse-  
84 TeH Telluryl radical teh  
85 D2O Deuterium oxide d2o  
86 H2O Water h2o  
87 HDO Water-d1 hdo  
88 D2S Hydrogen sulfide-d2 d2s  
89 H2S Hydrogen sulfide h2s  
90 H2Te Hydrogen Telluride h2te  
91 H3O+ hydronium cation h3o+  
92 H3Se+ Hydrogen Selenide, protonated h3se+  
93 Mn Manganese atom mn  
94 I Iodine atom iodine  
95 I- Iodine atom anion iodine-  
96 I+ Iodine atom cation iodine+  
97 DF Hydrofluoric acid-d df  
98 HF Hydrogen fluoride hf  
99 DCl Hydrochloric acid-d dcl  
100 HCl Hydrogen chloride hcl  
101 HI Hydrogen iodide hi  
102 HI+ Hydrogen iodide cation hi+  
103 H2F+ dihydrogen fluoride cation h2f+  
104 H2Br+ protonated hydrogen bromide h2br+  
105 H2I+ Iodonium h2i+  
106 Ne Neon atom ne  
107 Ar Argon atom ar  
108 Fe Iron atom fe  
109 Kr Krypton atom kr  
110 Xe Xenon atom xe  
111 HeLi+ Helium Lithium cation heli+  
112 NeH+ neon hydrogen cation neh+  
113 KrH+ Protonated Krypton krh+  
114 XeH+ Xenon, protonated xeh+  
115 H2Ar H2 Ar dimer h2ar  
116 Co Cobalt atom cobalt  
117 Ni Nickel atom ni  
118 Li2 Lithium diatomic li2  
119 NaLi lithium sodium lina  
120 NaLi- lithium sodium anion lina-  
121 NaLi+ lithium sodium cation lina+  
122 LiK Lithium Potassium lik  
123 Na2 Sodium diatomic na2  
124 NaK Sodium Potassium nak  
125 K2 Potassium diatomic k2  
126 Cu2 Copper diatomic cu2  
127 Be2 Beryllium diatomic be2  
128 BeMg Beryllium Magnesium bemg  
129 Mg2 Magnesium diatomic mg2  
130 Mg2- magnesium diatomic anion mg2-  
131 Mg2+ magnesium diatomic cation mg2+  
132 Ca2 Calcium diatomic ca2  
133 LiAl Lithium Aluminum lial  
134 NaAl Sodium aluminum naal  
135 B2- Boron diatomic anion b2-  
136 LiBH4 Lithium borohydride libh4  
137 B2H4 Diborane(4) D2d b2h4  
138 HBHHBH Diborane(4) C2V hbhhbh  
139 B2H6 Diborane b2h6  
140 Al2H6 dialane al2h6  
141 Ga2H6 digallane ga2h6  
142 BC+ boron monocarbide cation bc+  
143 C2 Carbon diatomic c2  
144 Si2- silcon diatomic anion si2-  
145 Si2+ silcon diatomic cation si2+  
146 C2H- Ethynyl anion c2h-  
147 C2H+ Ethynyl cation c2h+  
148 C2H2 Acetylene c2h2  
149 Si2H2 disilyne si2h2  
150 CuCH3 monomethyl copper cuch3  
151 CH2BH methyleneborane ch2bh  
152 C2H3- vinyl anion c2h3-  
153 C2H4 Ethylene c2h4  
154 CH2SiH2 silaethylene ch2sih2  
155 Si2H4 Disilene si2h4  
156 CH3BH2 methylborane ch3bh2  
157 C2H5- Ethyl anion c2h5-  
158 C2H5+ Ethyl cation c2h5+  
159 C2H6 Ethane c2h6  
160 CH3SiH3 methyl silane ch3sih3  
161 Si2H6 disilane si2h6  
162 GeH3CH3 methyl germane geh3ch3  
163 C2H7+ Ethane, protonated c2h7+  
164 BeN+ Beryllium mononitride cation ben+  
165 BN+ boron nitride cation bn+  
166 CN- cyanide anion cn-  
167 CN+ Cyano cation cn+  
168 CP- carbon monophosphide anion cp-  
169 SiN- silicon mononitride anion sin-  
170 SiN+ silicon mononitride cation sin+  
171 TiN Titanium mononitride tin  
172 N2 Nitrogen diatomic n2  
173 PN Phosphorus mononitride pn  
174 PN- phosphorus nitride anion pn-  
175 PN+ phosphorus nitride cation pn+  
176 P2 Phosphorus diatomic p2  
177 P2+ phosphorus diatomic cation p2+  
178 AsN Arsenic mononitride asn  
179 AsP Arsenic monophosphide asp  
180 SbN Antimony nitride sbn  
181 As2 Arsenic diatomic as2  
182 HNC hydrogen isocyanide hnc  
183 HCN Hydrogen cyanide hcn  
184 HCN- Hydrogen cyanide anion hcn-  
185 HCP Phosphaethyne hcp  
186 NNH+ Dinitrogen monohydride cation nnh+  
187 HPO Hydrogen phosphorus oxide hpo  
188 LiNH2 lithium amide linh2  
189 HBNH Boranimine hbnh  
190 CNH2+ N-protonated hydrogen isocyanide cnh2+  
191 HCNH+ N-protonated HCN hcnh+  
192 H2NN Isodiazene h2nn  
193 N2H2 (E)-diazene n2h2  
194 N2H2 (Z)-Diazene n2h2z  
195 CH2NH Methanimine ch3n  
196 CHNH2 aminomethylene chnh2  
197 CH2PH Phosphaethene ch3p  
198 BH2NH2 Boranamine bh2nh2  
199 CH2NH2+ methyleneamine cation ch2nh2+  
200 N2H4 Hydrazine n2h4  
201 P2H4 Diphosphine p2h4  
202 CH3NH2 methyl amine ch3nh2  
203 CH3PH2 Methyl phosphine ch3ph2  
204 SiH3NH2 Silane, amino sih3nh2  
205 N2H5+ protonated hydrazine n2h5+  
206 BH3PH3 borane phosphine bh3ph3  
207 BH3NH3 borane ammonia bh3nh3  
208 CH3NH3+ protonated methylamine ch3nh3+  
209 CH3PH3+ methyl phosphine, protonated ch3ph3+  
210 NH3NH3 Ammonia Dimer nh3nh3  
211 N2H7+ ammonia ammonium dimer n2h7+  
212 NaO- sodium oxide anion nao-  
213 NaO+ sodium oxide cation nao+  
214 BeO beryllium oxide beo  
215 BeS beryllium sulfide bes  
216 MgO magnesium oxide mgo  
217 MgO+ magnesium oxide cation mgo+  
218 CaO Calcium monoxide cao  
219 MgS magnesium sulfide mgs  
220 MgS- magnesium sulfide anion mgs-  
221 CaS Calcium sulfide cas  
222 ZnO zinc monoxide zno  
223 ZnS Zinc sulfide zns  
224 BeS- Beryllium monosulfide anion bes-  
225 AlO- Aluminum monoxide anion alo-  
226 AlO+ aluminum monoxide cation alo+  
227 BS- boron monosulfide anion bs-  
228 BS+ boron monosulfide cation bs+  
229 AlS- aluminum monosulfide anion als-  
230 AlS+ aluminum monosulfide cation als+  
231 BO+ boron monoxide cation bo+  
232 CO Carbon monoxide co  
233 CS carbon monosulfide cs  
234 SiO Silicon monoxide sio  
235 SiO- silicon monoxide anion sio-  
236 SiO+ silicon monoxide cation sio+  
237 SiS silicon monosulfide sis  
238 SiS- silicon monosulfide anion sis-  
239 SiS+ silicon monosulfide cation sis+  
240 CSe Carbon monoselenide cse  
241 CSe+ Carbon monoselenide cation cse+  
242 GeO Germanium monoxide geo  
243 GeS Germanium monosulfide ges  
244 SiSe Silicon Monoselenide sise  
245 GeSe Germanium monoselenide gese  
246 NO+ nitric oxide cation no+  
247 NS+ nitrogen sulfide cation ns+  
248 PO- phosphorus monoxide anion po-  
249 PO+ phosphorus monoxide cation po+  
250 PS+ phosphorus monosulfide cation ps+  
251 O2-- dioxygen dianion o2--  
252 SO- sulfur monoxide anion so-  
253 S2- sulfur diatomic anion s2-  
254 S2+ sulfur diatomic cation s2+  
255 SeO+ selenium monoxide cation seo+  
256 SeS Selenium monosulfide ses  
257 SeS- selenium monosulfide anion ses-  
258 SeS+ selenium monosulfide cation ses+  
259 TeO Tellurium monoxide teo  
260 Se2+ selenium diatomic cation se2+  
261 Te2 Tellurium diatomic te2  
262 LiOH lithium hydroxide lioh  
263 NaOH sodium hydroxide naoh  
264 KOH Potassium hydroxide koh  
265 CaOH Calcium monohydroxide caoh  
266 HBO Boron hydride oxide hbo  
267 HBS hydrogen boron sulfide hbs  
268 COH+ Carbon Monoxide, protonated coh+  
269 HCS- Thioformyl anion hcs-  
270 HNS Sulfur imide hns  
271 HSO+ Sulfur Monoxide, S-protonated HSO+  
272 H2CO Formaldehyde h2co  
273 HOCH hydroxycarbene hoch  
274 H2CS Thioformaldehyde h2cs  
275 H2CSe Selenoformaldehyde h2cse  
276 H2O2 Hydrogen peroxide h2o2  
277 H2OO water oxide h2oo  
278 HOSH hydrogen thioperoxide hosh  
279 H2S2 Disulfane h2s2  
280 H2Se2 hydrogen diselenide h2se2  
281 CH2OH+ hydroxymethyl cation ch2oh+  
282 CH3O- methoxy anion ch3o-  
283 H2CSH+ Thioformaldehyde, protonated h2csh+  
284 NH2OH hydroxylamine nh2oh  
285 NH3O Ammonia Oxide nh3o  
286 H2POH Phosphinous acid h2poh  
287 H3PO Phosphine oxide h3po  
288 NH2SH Thiohydroxylamine nh2sh  
289 NH3S sulfidoazane nh3s  
290 H3O2+ hydrogen peroxide, protonated h3o2+  
291 CH3OH Methyl alcohol ch3oh  
292 CH3SH Methanethiol ch3sh  
293 SiH3OH silanol sih3oh  
294 CH3SeH Methane selenol ch3seh  
295 H2OH2O water dimer h2oh2o  
296 CH3OH2+ Methanol, protonated ch3oh2+  
297 CH3SH2+ protonated methylsulfide ch3sh2+  
298 H2ONH3 Water Ammonia Dimer h2onh3  
299 H5O2+ Dihydroxonium ion h5o2+  
300 LiF lithium fluoride lif  
301 LiCl lithium chloride licl  
302 LiCl- lithium chloride anion licl-  
303 LiCl+ lithium chloride cation licl+  
304 NaF sodium fluoride naf  
305 NaF- sodium fluoride anion naf-  
306 KF Potassium Fluoride kf  
307 NaCl Sodium Chloride nacl  
308 NaCl- sodium chloride anion nacl-  
309 NaCl+ sodium chloride cation nacl+  
310 KCl Potassium Chloride kcl  
311 CuF Copper monofluoride cuf  
312 LiBr Lithium Bromide libr  
313 CuCl Copper monochloride cucl  
314 NaBr Sodium Bromide nabr  
315 NaBr- sodium bromide anion nabr-  
316 NaBr+ sodium bromide cation nabr+  
317 KBr Potassium Bromide kbr  
318 LiI Lithium Iodide lii  
319 NaI Sodium Iodide nai  
320 KI Potassium Iodide ki  
321 MgF- magnesium fluoride anion mgf-  
322 MgF+ magnesium fluoride cation mgf+  
323 CaF Calcium monofluoride caf  
324 MgCl- magnesium monochloride anion mgcl-  
325 MgCl+ magnesium monochloride cation mgcl+  
326 ZnF- Zinc monofluoride anion znf-  
327 ZnF+ Zinc monofluoride cation znf+  
328 BeCl- beryllium monochloride anion becl-  
329 BeCl+ beryllium monochloride cation becl+  
330 BF Boron monofluoride bf  
331 BF- Boron monofluoride anion bf-  
332 BF+ Boron monofluoride cation bf+  
333 AlF Aluminum monofluoride alf  
334 AlF- Aluminum monofluoride anion alf-  
335 AlF+ Aluminum monofluoride cation alf+  
336 BCl boron monochloride bcl  
337 AlCl Aluminum monochloride alcl  
338 ScF Scandium monofluoride scf  
339 BBr Boron monobromide bbr  
340 AlBr Aluminum monobromide albr  
341 AlI Aluminum monoiodide ali  
342 GaBr Gallium monobromide gabr  
343 CF+ carbon monofluoride cation cf+  
344 CCl- carbon monochloride anion ccl-  
345 CCl+ carbon monochloride cation ccl+  
346 SiF+ silicon monofluoride cation sif+  
347 SiCl- silicon monochloride anion sicl-  
348 SiCl+ silicon monochloride cation sicl+  
349 GeF+ Germanium monofluoride cation gef+  
350 GeCl+ Germanium monochloride cation gecl+  
351 PF+ phosphorus monofluoride cation pf+  
352 PCl+ phosphorus monochloride cation pcl+  
353 SbF Antimony monofluoride sbf  
354 SbCl Antimony monochloride sbcl  
355 FO- flourine oxide anion fo-  
356 FO+ fluorine monoxide cation fo+  
357 ClO- chlorine monoxide anion clo-  
358 SF- sulfur monofluoride anion sf-  
359 SCl- sulfur monochloride anion scl-  
360 BrO- Bromine monoxide anion bro-  
361 IO Iodine monoxide io  
362 BrCl Bromine monochloride brcl  
363 F2 Fluorine diatomic f2  
364 ClF- clorine monofluoride anion clf-  
365 Cl2 Chlorine diatomic cl2  
366 BrF Bromine monofluoride brf  
367 BrF- bromine fluoride anion brf-  
368 IF Iodine monofluoride if  
369 Br2 Bromine diatomic br2  
370 ICl Iodine monochloride icl  
371 IBr Iodine monobromide ibr  
372 I2 Iodine diatomic i2  
373 I2+ Iodine diatomic cation i2+  
374 HCF Fluoromethylene hcf  
375 HCCl Chloromethylene hccl  
376 HSiF fluorosilylene hsif  
377 HSiCl Chlorosilylene hsicl  
378 HSiBr monobromosilylene hsibr  
379 CHBr bromomethylene chbr  
380 HOF Hypofluorous acid hfo  
381 DOCl Hypochlorous acid-d docl  
382 HOCl hypochlorous acid hocl  
383 HOBr Hypobromous acid hobr  
384 HOI Hypoiodous acid hoi  
385 F2H+ Fluorine, protonated f2h+  
386 FHF Hydrogen difluoride fhf  
387 ClFH+ Chlorine fluoride, F-protonated clfh+  
388 FClH+ Chlorine fluoride, Cl-protonated fclh+  
389 Cl2H+ Chlorine, protonated cl2h+  
390 CH2F+ fluoromethyl cation ch2f+  
391 CH2Cl+ chloromethyl cation ch2cl+  
392 NH2F monofluoroamine nh2f  
393 NH2Cl chloramine nh2cl  
394 H2F2 Hydrogen fluoride dimer h2f2  
395 CD3F methylfluoride-d3 cd3f  
396 CH3F Methyl fluoride ch3f  
397 CD3Cl methyl chloride d3 cd3cl  
398 CH3Cl Methyl chloride ch3cl  
399 SiH3F monofluorosilane sih3f  
400 SiH3Cl chlorosilane sih3cl  
401 GeH3F monofluorogermane geh3f  
402 GeH3Cl monochlorogermane geh3cl  
403 SiH3Br bromosilane sih3br  
404 CH3I methyl iodide ch3i  
405 SiH3I Silyl Iodide sih3i  
406 NH3Cl+ protonated monochloroammonia nh3cl+  
407 CH3ClH+ methyl chloride, protonated ch3clh+  
408 NH4Cl Ammonium chloride nh4cl  
409 LiNe+ Lithium Neon cation line+  
410 Ne2 Neon diatomic ne2  
411 Ar2 Argon diatomic ar2  
412 Li3+ Lithium trimer cation li3+  
413 SiC2 Silicon dicarbide sic2  
414 C3H3+ cyclopropenyl cation cpr+  
415 C3H4 cyclopropene cprop  
416 CH2CCH2 allene allene  
417 CH3CCH propyne propyne  
418 C3H5+ Allyl cation allyl+  
419 Zn(CH3)2 dimethyl zinc dmz  
420 C3H6 Cyclopropane c3h6  
421 CH2CHCH3 Propene propene  
422 C3H7+ cyclopropane, protonated c3h7+  
423 CH3CHCH3+ Isopropyl cation prop2yl+  
424 C3H8 Propane propane  
425 SiH2(CH3)2 dimethylsilane dms  
426 Si3H8 trisilane si3h8  
427 NaCN Sodium Cyanide nacn  
428 KCN Potassium cyanide kcn  
429 CuCN Copper cyanide cucn  
430 AlCN Aluminum monocyanide alcn  
431 AlNC Aluminum isocyanide alnc  
432 CN2 3H-Diazirin-3-ylidene cn2  
433 N3- azide anion n3-  
434 HCNN diazomethyl radical hcnn  
435 HNCNH diiminomethane hncnh  
436 CH2N2 diazirine ch2n2  
437 CH2NN diazomethane ch2nn  
438 NH2CN cyanamide cyanamide  
439 HNNNH+ 1,2-Triazadienium n2h3+  
440 NH2NN+ hydrazoic acid, protonated nh2nn+  
441 CH3CN Acetonitrile ch3cn  
442 CH3NC methyl isocyanide ch3nc  
443 CHNCH2 2H-Azirine c157164  
444 CHNHCH 1H-Azirine chnhch  
445 H2CCNH Ethenimine ch2cnh  
446 H2CNCH methyleneaminomethylene ch2nch  
447 HCCNH2 Ethynamine hccnh2  
448 HNCNH2+ diiminomethane, protonated hncnh2+  
449 NCNH3+ Cyanamide, protonated ncnh3+  
450 NH2CNH+ cyanamide, cn protonated nh2cnh+  
451 NH3CN+ cyanamide, amine protonated nh3cn+  
452 NHCHNH2 aminomethanimine cn2h4  
453 C2H5N Aziridine c2h5n  
454 CH2CHNH2 aminoethene aminoethene  
455 CH2NCH3 N-methylmethanimine nmm  
456 CH3CHNH ethanimine ethanimine  
457 NH2BHNH2 diaminoborane nh2bhnh2  
458 C2H5NH+ Protonated Aziridine c2h5nh+  
459 C2H6N+ aziridine, protonated c2h6n+  
460 NH2CH2NH2 diaminomethane nh2ch2nh2  
461 CH3CH2NH2 Ethylamine etam  
462 CH3NHCH3 Dimethylamine ch3nhch3  
463 CH3PHCH3 dimethylphosphine ch3phch3  
464 NH2CH2NH3+ diaminoethane, protonated pdam  
465 (CH3)2NH2+ dimethylammonium cation dmam  
466 CH3CH2NH3+ ethylamine, protonated pea  
467 Li2O dilithium oxide li2o  
468 Li2S dilithium sulfide li2s  
469 Na2O disodium monoxide na2o  
470 Na2S Sodium sulfide na2s  
471 CNO- fulminate cno-  
472 NCO- cyanate nco-  
473 SCN- thiocyanide anion scn-  
474 BO2- Boron dioxide anion bo2-  
475 NNS Nitrogen sulfide nns  
476 PPO Phosphorus oxide phosphide ppo  
477 CO2 Carbon dioxide co2  
478 OCS Carbonyl sulfide cos  
479 SiO2 silicon dioxide sio2  
480 CS2 Carbon disulfide cs2  
481 TiO2 Titanium dioxide tio2  
482 SiS2 Silicon disulfide sis2  
483 GeO2 Germanium dioxide geo2  
484 OCSe Carbonyl selenide ocse  
485 SCSe Carbon sulfide selenide scse  
486 GeS2 Germanium disulfide ges2  
487 CSe2 Carbon diselenide cse2  
488 SCTe Carbon sulfide Telluride scte  
489 PO2- Phosphorus dioxide anion po2-  
490 O3 Ozone o3  
491 SSO Disulfur monoxide sso  
492 S3 Sulfur trimer s3  
493 SeO2 Selenium dioxide seo2  
494 TeO2 Tellurium Dioxide teo2  
495 CS2H+ Carbon disulfide, protonated cs2h+  
496 HCNO fulminic acid hcno  
497 HNCO Isocyanic acid hnco  
498 HOCN cyanic acid hocn  
499 HNCS Isothiocyanic acid hncs  
500 HSCN thiocyanic acid hscn  
501 HCO2- formate anion hco2-  
502 HNNO nitrosoazane hnno  
503 HNNO+ Nitrous oxide, N-protonated hnno+  
504 NNOH+ Nitrous Oxide, O-protonated nnoh+  
505 HNO2 Nitrous acid hno2  
506 O3H+ protonated ozone o3h+  
507 SO2H+ protonated sulfur dioxide so2h+  
508 C2H2O Oxirene oxirene  
509 CH2CO Ketene ch2co  
510 HCCOH ethynol hccoh  
511 CH2CS Thioketene ch2cs  
512 Be(OH)2 Beryllium hydroxide beo2h2  
513 Mg(OH)2 Magnesium dihydroxide h2mgo2  
514 NH2NO Nitrosamide nh2no  
515 CH2O2 Dioxirane diox  
516 H2COO Dioxymethyl radical h2coo  
517 H2COO+ dioxymethyl cation h2coo+  
518 HCOOH Formic acid ch2o2  
519 H2O3 Hydrogen trioxide h2o3  
520 HSSSH trisulfane hsssh  
521 NaOCH3 Sodium methoxide naoch3  
522 CH2BOH hydroxy(methylene)borane ch2boh  
523 BH3CO Borane carbonyl bh3co  
524 CH3BO Borane, methyloxo- ch3bo  
525 CH2COH+ ketene, protonated ch2coh+  
526 CH3CO- Acetyl anion ch3co-  
527 CH3CO+ acetyl cation ch3co+  
528 CH2NOH formaldoxime ch2noh  
529 CH3NO nitrosomethane ch3no  
530 CHONH2 formamide formamide  
531 CNOH3 1,2-oxaziridine cnoh3  
532 HOCHNH hydroxymethylimine hochnh  
533 CHSNH2 thioformamide chsnh2  
534 NHCHSH Methanimidothioic acid nhchsh  
535 CH3OO- methylperoxy anion ch3oo-  
536 C2H4O Ethylene oxide c2h4o  
537 CH2CHOH ethenol ch2choh  
538 CH3CHO Acetaldehyde ch3cho  
539 C2H4S Thiirane thiirane  
540 CH2CHSH Ethenethiol ch2chsh  
541 CH3CHS Thioacetaldehyde ch3chs  
542 H2CONH2+ protonated formamide h2conh2+  
543 NH2CHOH+ Formamide, O-protonated nh2choh+  
544 NH3CHO+ Formamide, N-Protonated nh3cho+  
545 CH2(OH)2 methanediol ch2o2h2  
546 CH3OOH Methyl peroxide ch3ooh  
547 CH3SSH Hydrogen methyl disulfide ch3ssh  
548 HSCH2SH Methanedithiol ch4s2  
549 H2OH2CO water formaldehyde dimer h2oh2co  
550 C2H4OH+ ethylene oxide, protonated c2h4oh+  
551 CH3CHOH+ acetaldehyde, protonated ch3choh+  
552 NH2CH2OH aminomethanol nh2ch2oh  
553 CH3CH2OH Ethanol etoh  
554 CH3OCH3 Dimethyl ether meome  
555 CH3SCH3 Dimethyl sulfide mesme  
556 CH3SeCH3 dimethylselenide dmse  
557 CH3OHH2O methanol water dimer ch3ohh2o  
558 H2OCH3OH water methanol dimer h2och3oh  
559 CNF iso cyanogen fluoride cnf  
560 FCN Cyanogen fluoride fcn  
561 ClCN chlorocyanogen clcn  
562 BrCN Cyanogen bromide brcn  
563 ICN Cyanogen iodide icn  
564 FBO Boron monofluoride monoxide fbo  
565 BeF2 Beryllium fluoride bef2  
566 MgF2 Magnesium fluoride mgf2  
567 BeCl2 Beryllium chloride becl2  
568 MgCl2 Magnesium dichloride mgcl2  
569 CaCl2 Calcium Chloride cacl2  
570 ZnCl2 Zinc dichloride zncl2  
571 BeBr2 Beryllium bromide bebr2  
572 CaBr2 Calcium dibromide cabr2  
573 CaF2 Calcium difluoride caf2  
574 FCO+ Carbonyl fluoride cation fco+  
575 FNO Nitrosyl fluoride fno  
576 ClNO Nitrosyl chloride clno  
577 FNS Thionitrosyl fluoride fns  
578 FSN Thiazyl fluoride fsn  
579 OPCl Phosphorus oxychloride opcl  
580 INO Nitrosyl iodide ino  
581 CF2 Difluoromethylene cf2  
582 CFCl chlorofluoromethylene cfcl  
583 CCl2 dichloromethylene ccl2  
584 SiCl2 Dichlorosilylene sicl2  
585 GeF2 Germanium difluoride gef2  
586 GeCl2 Germanium dichloride gecl2  
587 CBr2 dibromomethylene cbr2  
588 PF2+ Phosphorus difluoride cation pf2+  
589 FClO chlorosyl fluoride fclo  
590 F2O Difluorine monoxide f2o  
591 ClOF Chlorine hypofluorite clof  
592 SF2 sulfur difluoride sf2  
593 Cl2O Dichlorine monoxide cl2o  
594 SCl2 Sulfur dichloride scl2  
595 SeF2 Selenium difluoride sef2  
596 SeCl2 Selenium Dichloride secl2  
597 SBr2 Sulfur dibromide sbr2  
598 SeBr2 Selenium dibromide sebr2  
599 F3- trifluoride anion f3-  
600 Cl3- trichloride anion cl3-  
601 Br3- tribromide anion br3-  
602 I3- triiodide i3-  
603 SFCl Sulfur chloride fluoride sfcl  
604 HCCF Fluoroacetylene hccf  
605 HCCCl Chloroacetylene hcccl  
606 HCCBr bromoacetylene hccbr  
607 HFCO formyl fluoride hfco  
608 BHF2 Difluoroborane bhf2  
609 BHCl2 Borane, dichloro- bhcl2  
610 CHF2+ difluoromethyl cation chf2+  
611 CHFCl+ Chlorofluoromethyl cation chfcl+  
612 CHCl2+ dichloromethyl cation chcl2+  
613 HOClO Chlorous acid hoclo  
614 NHF2 difluoramine nhf2  
615 NHCl2 dichloroamine nhcl2  
616 CH2F2 Methane, difluoro- ch2f2  
617 CH2FCl fluorochloromethane ch2fcl  
618 SiH2F2 difluorosilane sih2f2  
619 CH2Cl2 Methylene chloride ch2cl2  
620 CH2BrF Methane, bromofluoro- ch2fbr  
621 CH2BrCl Methane, bromochloro- ch2clbr  
622 CH2FI fluoroiodomethane ch2fi  
623 CH2Br2 dibromomethane ch2br2  
624 CH2ClI chloroiodomethane ch2cli  
625 CH2BrI bromoiodomethane ch2bri  
626 CH2I2 Diiodomethane ch2i2  
627 SiH2Cl2 dichlorosilane sih2cl2  
628 CH3MgBr Methyl Magnesium Bromide ch3mgbr  
629 CH2CHF+ fluoroethene cation ch2chf+  
630 C2H3Cl Ethene, chloro- ch2chcl  
631 C2H3Br vinyl bromide c2h3br  
632 C2H3I Vinyl iodide c2h3i  
633 CH2FOH fluoromethanol ch2foh  
634 C2H5F fluoroethane c2h5f  
635 CH3CH2Cl Ethyl chloride c2h5cl  
636 CH3SiFH2 fluoromethylsilane ch3sifh2  
637 C2H5Br Ethyl bromide etbr  
638 C2H5I Ethyl iodide c2h5i  
639 KrF2 Krypton difluoride krf2  
640 XeF2 Xenon difluoride xef2  
641 B4H10 Tetraborane(10) b4h10  
642 C4+ Carbon tetramer cation c4+  
643 C4H2 Diacetylene c4h2  
644 C2H3CCH 1-Buten-3-yne c2h3cch  
645 C4H4 cyclobutadiene cbd  
646 C4H4 Tetrahedrane c4h4  
647 H2CCCCH2 Butatriene h2cccch2  
648 C4H6 1-Methylcyclopropene c3100047  
649 C4H6 Cyclobutene c822355  
650 C4H6 Methylenecyclopropane c6142730  
651 CH2CCHCH3 1,2-Butadiene butad12  
652 CH2CHCHCH2 1,3-Butadiene c106990  
653 CH3CCCH3 2-Butyne c503173  
654 CHCCH2CH3 1-Butyne c107006  
655 C4H8 methylcyclopropane mcp  
656 CH2C(CH3)CH3 1-Propene, 2-methyl- isobute  
657 CH2CHCH2CH3 1-Butene bute1  
658 CH3CHCHCH3 2-Butene, (E)- bute2e  
659 CH3CHCHCH3 2-Butene, (Z)- bute2z  
660 B(CH3)3 trimethylborane bme3  
661 Al(CH3)3 trimethyl aluminum tma  
662 CH3CH(CH3)CH3 Isobutane isobutane  
663 CH3CH2CH2CH3 Butane butane  
664 SiH(CH3)3 trimethylsilane trimsi  
665 Li3N trilithium nitride li3n  
666 C2N2 Cyanogen c2n2  
667 P4 Phosphorus tetramer p4  
668 As4 Arsenic tetramer as4  
669 HCCCN Cyanoacetylene hcccn  
670 H2CNCN cyanamide, methylene ch2ncn  
671 HNCCNH Ethenediimine hnccnh  
672 C3H3N acrylonitrile ch2chcn  
673 CH3N3 methyl azide ch3n3  
674 NH2CCNH2 Diaminoacetylene daa  
675 NH2CH2CN Aminoacetonitrile aan  
676 CH3NHN2+ methyl azide, protonated ch3nhn2+  
677 C2H5CN ethyl cyanide c2h5cn  
678 CH5N3 Guanidine guanidine  
679 C4H6 Bicyclo[1.1.0]butane c157335  
680 CH3NNCH3 (Z)-1,2-Dimethyldiazene dmdiazz  
681 H2NCHCHNH2 diaminoethylene dae  
682 CH6N3+ guanidinium ch6n3+  
683 C3H7N Cyclopropylamine cpram  
684 CH7N3 triaminomethane tam  
685 C3H7N Azetidine azet  
686 C4H8 cyclobutane cbutane  
687 C2H8N2 Ethylenediamine ethdiam  
688 CH3NHNHCH3 dimethyl hydrazine dmh  
689 CH3CH(NH2)CH3 2-Propanamine pram2  
690 N(CH3)3 Trimethylamine trimeam  
691 NH2CH2CH2CH3 1-Propanamine pram1  
692 P(CH3)3 trimethylphosphine tmp  
693 N(SiH3)3 trisilylamine tsa  
694 As(CH3)3 trimethyl arsine tmas  
695 (CH3)3NH+ protonated trimethyl amine ptma  
696 C3H7NH3+ n-propylamine, protonated c3h7nh2  
697 Li2O2 dilithium dioxide li2o2  
698 Na2O2 disodium dioxide na2o2  
699 K2O2 dipotassium dioxide k2o2  
700 C3O Tricarbon monoxide c3o  
701 B2O2 Diboron dioxide b2o2  
702 ONNO NO dimer onno  
703 S2N2 Disulfur dinitride s2n2  
704 CO3 Carbon trioxide co3  
705 CO3-- carbonate co3--  
706 CS3-- Carbonotrithioate cs3--  
707 NO3- nitrate anion no3-  
708 SO3 Sulfur trioxide so3  
709 SO3-- Sulfate dianion so3--  
710 SeO3 selenium trioxide seo3  
711 S4 Sulfur tetramer s4  
712 TeO3 Tellurium trioxide teo3  
713 HCO3- bicarbonate anion hco3-  
714 HNO3 Nitric acid hno3  
715 NH2NO2 nitramide nh2no2  
716 C2H2CO cyclopropenone c2h2co  
717 C3H2O Propadienal c3h2o  
718 HCCCHO 2-propynal hcccho  
719 C2H2O2+ Ethanedial cation c2h2o2+  
720 H2CO3 Carbonic acid h2co3  
721 H2CS3 thiocarbonic acid h2cs3  
722 H2NO3+ Nitric Acid, Protonated h2no3+  
723 H2SO3 Sulfurous acid h2so3  
724 C2H3NO Nitrosoethylene c2h3no  
725 CH3NCO methylisocyante ch3nco  
726 HOCH2CN cyanomethanol hoch2cn  
727 CH3COO- acetate anion ch3coo-  
728 CH3NO2 Methane, nitro- ch3no2  
729 CH3ONO Methyl nitrite ch3ono  
730 NH2COOH Carbamic acid nh2cooh  
731 H3BO3 Boric acid h3bo3  
732 H3AlO3 Aluminum hydroxide h3alo3  
733 H3CO3+ carbonic acid, protonated h3co3+  
734 C3H4O 2-Propyn-1-ol c107197  
735 C3H4O allenol c9000071  
736 C3H4O Cyclopropanone cpone  
737 C3H4O Methylketene c6004440  
738 CH2CHCHO Acrolein c3h4o  
739 NH2CONH2 Urea urea  
740 NH2CONH2+ Urea cation urea+  
741 NH2CSNH2 Thiourea thiourea  
742 C2H4O2 1,3-dioxetane c2h4o2  
743 CH3COOH Acetic acid ch3cooh  
744 CH3OCHO methyl formate ch3ocho  
745 CHOCH2OH hydroxy acetaldehyde haa  
746 NH2COOH2+ Carbamic acid, O-protonated nh2cooh2+  
747 NH3COOH+ protonated Carbamic acid nh3cooh+  
748 H2OHCOOH Water formic acid dimer 1 h2ohcooh_10  
749 H2OHCOOH Water formic acid dimer 2 h2ohcooh_11  
750 HCOOHH2O Formic acid water dimer hcoohh2o  
751 HOCH2OOH hydroxy methyl peroxide hoch2ooh  
752 CH2C(OH)NH2 1-amino vinyl alchohol ava  
753 CH3C(OH)=NH Ethaninidic acid eia  
754 CH3CHNOH Acetaldoxime acetaldoxime  
755 CH3CONH2 Acetamide acetamide  
756 HCONHCH3 N-methylformamide nmfa  
757 CH3CSNH2 Ethanethioamide ch3csnh2  
758 CH5N2O+ urea, N-protonated ch4n2o+  
759 H2NCOHNH2+ urea, protonated ureah+  
760 CH3NNCH3 (E)-1,2-Dimethyldiazene dmdiaze  
761 C3H5OH Cyclopropanol cproh  
762 C3H6O 2-Propen-1-ol c107186  
763 C3H6O Acetone enol enol  
764 C3H6O Oxetane oxetane  
765 C3H6O Propylene oxide prox  
766 CH3CH2CHO Propanal propanal  
767 CH3COCH3 Acetone acetone  
768 C3H6S Thietane thietane  
769 C3H6S Thiirane, methyl- methiirane  
770 CH3CSCH3 Thioacetone ch3csch3  
771 C2H6O2 1,2-Ethanediol ethdiol  
772 CH3OOCH3 dimethylperoxide dmp  
773 CH3SOCH3 Dimethyl sulfoxide dmso  
774 CH2SHCH2SH 1,2-Ethanedithiol ethdisl  
775 CH3SSCH3 Disulfide, dimethyl ch3ssch3  
776 CH3COHCH3+ acetone, protonated acetoneh+  
777 HOCH2CH2NH2 monoethanolamine mea  
778 C3H7OH 1-Propanol proh  
779 CH3CHOHCH3 Isopropyl alcohol isoproh  
780 CH3OC2H5 Ethane, methoxy- etome  
781 C3H7SH 1-Propanethiol prsh  
782 CH3CHSHCH3 2-Propanethiol isoprsh  
783 CH3SCH2CH3 Ethane, (methylthio)- etsme  
784 H2OCH3OCH3 water dimethylether dimer h2och3och3  
785 Li2F2 Lithium fluoride dimer li2f2  
786 Na2F2 Sodium Fluoride Dimer na2f2  
787 Na2Cl2 Disodium dichloride na2cl2  
788 C2F2 difluoroacetylene c2f2  
789 C2Cl2 dichloroacetylene c2cl2  
790 FNO2 Nitryl fluoride fno2  
791 FONO Nitrosyl hypofluorite fono  
792 ClNO2 Nitryl chloride clno2  
793 ClONO chlorine nitrite clono  
794 N2F2 (Z)-Difluorodiazene n2f2_z  
795 N2F2 Dinitrogen difluoride, (E)- n2f2_e  
796 CF2O Carbonic difluoride f2co  
797 CCl2O Phosgene cl2co  
798 Cl2CS Thiophosgene cl2cs  
799 BF3 Borane, trifluoro- bf3  
800 AlF3 Aluminum trifluoride alf3  
801 BClF2 Chlorodifluoroborane bclf2  
802 AlF2Cl Aluminum chloride difluoride alclf2  
803 ScF3 Scandium trifluoride ScF3  
804 AlFCl2 Aluminum dichloride fluoride alcl2f  
805 BCl3 Borane, trichloro- bcl3  
806 GaF3 Gallium trifluoride gaf3  
807 AlCl3 Aluminum trichloride alcl3  
808 GaCl3 Gallium trichloride gacl3  
809 BBr3 Boron tribromide bbr3  
810 AlBr3 Aluminum Bromide albr3  
811 ClO3 Chlorine trioxide clo3  
812 ClO3- chlorate anion clo3-  
813 BrO3- Bromate anion bro3-  
814 SiCl3 trichlorosilyl radical sicl3  
815 SiCl3+ trichlorosilyl cation sicl3+  
816 FOOF Perfluoroperoxide foof  
817 ClO2F Chloryl fluoride clo2f  
818 F2SO Thionyl Fluoride f2so  
819 ClOOCl Dichlorine dioxide cloocl  
820 FSSF Difluorodisulfane fssf  
821 S2F2 Thio-thionyl fluoride s2f2  
822 SOCl2 thionyl chloride socl2  
823 SSCl2 Thiothionyl chloride sscl2  
824 SeOCl2 selenium oxychloride seocl2  
825 PF3 Phosphorus trifluoride pf3  
826 NCl3 nitrogen trichloride ncl3  
827 AsF3 Arsenic trifluoride asf3  
828 PCl3 Phosphorus trichloride pcl3  
829 SbF3 Antimony Trifluoride sbf3  
830 AsCl3 Arsenous trichloride ascl3  
831 SbCl3 Antimony Trichloride sbcl3  
832 NBr3 Nitrogen Tribromide nbr3  
833 PBr3 Phosphorus tribromide pbr3  
834 AsBr3 Arsenic tribromide asbr3  
835 NI3 Nitrogen triiodide ni3  
836 PI3 Phosphorus triiodide pi3  
837 ClSSCl Disulfur dichloride s2cl2  
838 ClF3 Chlorine trifluoride clf3  
839 BrF3 Bromine trifluoride brf3  
840 IF3 iodone trifluoride if3  
841 HClO3 Chloric Acid hclo3  
842 CHF3 Methane, trifluoro- chf3  
843 CHF2Cl difluorochloromethane chf2cl  
844 SiHF3 trifluorosilane sihf3  
845 CHFCl2 fluorodichloromethane chfcl2  
846 CDCl3 trichloromethane-d cdcl3  
847 CHCl3 Chloroform chcl3  
848 SiHCl3 Trichlorosilane sihcl3  
849 CHFClBr fluorochlorobromomethane chfclbr  
850 CHF2I difluoroiodomethane chf2i  
851 CHBr2F dibromofluoromethane chbr2f  
852 CHFClI fluorochloroiodomethane chfcli  
853 CHCl2I dichloroiodomethane chcl2i  
854 CHBr3 bromoform chbr3  
855 CHI3 Iodoform chi3  
856 NF3H+ protonated nitrogen trifluoride nf3h+  
857 AsF3H+ Arsenic trifluoride, protonated asf3h+  
858 C2H2F2 Ethene, 1,2-difluoro-, (E)- c2h2f2e  
859 C2H2F2 Ethene, 1,2-difluoro-, (Z)- c2h2f2z  
860 CH2CF2 Ethene, 1,1-difluoro- ch2cf2  
861 C2H2ClF 1-chloro-1-fluoroethylene c2h2clf  
862 CHFCHCl (E)-1-chloro-2-fluoroethene chfchcle  
863 CHFCHClz (Z)-1-Chloro-2-fluoroethene chfchclz  
864 CH2CCl2 Ethene, 1,1-dichloro- ch2ccl2  
865 CHClCHCl Ethene, 1,2-dichloro-, (E)- chclchcle  
866 CHClCHCl Ethene, 1,2-dichloro-, (Z)- chclchclz  
867 C2H2Br2 1,1-dibromoethene c2h2br2  
868 CHBrCHBr Ethene, 1,2-dibromo-, (E)- chbrchbre  
869 CHBrCHBr Ethene, 1,2-dibromo-, (Z)- chbrchbrz  
870 CH2FCHO Fluoroacetaldehyde ch2fcho  
871 CH3COF Acetyl fluoride ch3cof  
872 CH3COCl Acetyl Chloride ch3cocl  
873 C2H4F2 1,2-difluoroethane c2h4f2  
874 CH3CHF2 Ethane, 1,1-difluoro- ch3chf2  
875 CH2FCH2Cl Ethane, 1-chloro-2-fluoro- ch2fch2cl  
876 CH3CHFCl Ethane, 1-chloro-1-fluoro- ch3chfcl  
877 CH2ClCH2Cl Ethane, 1,2-dichloro- ch2clch2cl  
878 CH3CHCl2 Ethane, 1,1-dichloro- ch3chcl2  
879 CH2BrCH2Cl 1-bromo-2-chloroethane ch2brch2cl  
880 CH2CFCH3 2-fluoropropene 2fpro  
881 CH2CHCH2F Allyl Fluoride allylf  
882 CH3CHCHF trans-1-Fluoro-1-propene propene1ft  
883 C3H5Cl 1-Propene, 3-chloro- prop1cl3  
884 C3H5Cl 1-chloro-1-propene(E) prop1cl1e  
885 C3H5Cl 1-chloro-1-propene(Z) prop1cl1z  
886 CH2FCH2OH 2-fluoroethanol ch2fch2oh  
887 CH2ClCH2OH 2-Chloroethanol ch2clch2oh  
888 CH2ClCH2OH2+ 2-chloroethanol, protonated ch2clch2oh2+  
889 CH2FCH2CH3 1-Fluoropropane prf1  
890 CH3CHFCH3 2-Fluoropropane prf2  
891 CH2ClCH2CH3 Propane, 1-chloro- prcl1  
892 CH3CHClCH3 Propane, 2-chloro- prcl2  
893 C3H9O+ trimethyl oxonium cation c3h9o+  
894 B5H9 pentaborane9 b5h9  
895 C5H4 pentatetraene ptrene  
896 C5H5- cylopentadienyl anion c5h5-  
897 C5H6 1,3-Cyclopentadiene c542927  
898 C5H6 1-Buten-3-yne, 2-methyl- c78808  
899 C5H6 3-Penten-1-yne, (E)- c2004695  
900 C5H6 3-Penten-1-yne, (Z)- c1574409  
901 C5H6 Bicyclo[2.1.0]pent-2-ene c5164352  
902 C5H6 Cyclopropylacetylene c6746947  
903 C5H6 Propellane propellane  
904 C5H7 1,3-pentadienyl radical pdyl  
905 C5H8 1,2-Butadiene, 3-methyl- c598254  
906 C5H8 1,2-Pentadiene c591957  
907 C5H8 1,3-Butadiene, 2-methyl- c78795  
908 C5H8 1,3-Pentadiene, (E)- c2004708  
909 C5H8 1,3-Pentadiene, (Z)- c1574410  
910 C5H8 1,4-Pentadiene c591935  
911 C5H8 1-pentyne a1pentyne  
912 C5H8 2,3-Pentadiene c591968  
913 C5H8 Bicyclo[1.1.1]pentane bcp  
914 C5H8 Cyclobutane, methylene- c1120565  
915 C5H8 Cyclopentene c142290  
916 C5H8 Ethenylcyclopropane c693867  
917 CH3CCCH2CH3 2-Pentyne 2pentyne  
918 C5H10 1-Butene, 2-methyl- c563462  
919 C5H10 2-Butene, 2-methyl- c513359  
920 C5H10 2-Pentene, (E)- c646048  
921 C5H10 2-Pentene, (Z)- c627203  
922 C5H10 Cyclopentane c287923  
923 C5H10 Cyclopropane, 1,1-dimethyl- c1630940  
924 CH2CHCH2CH2CH3 1-pentene pentene  
925 C5H12 Butane, 2-methyl- buta2  
926 C5H12 Pentane pentane  
927 C5H12 Propane, 2,2-dimethyl- neopentane  
928 Si(CH3)4 tetramethylsilane tms  
929 N2O3 Dinitrogen trioxide n2o3  
930 C3H2N2 Malononitrile c3h2n2  
931 CH2N4 1H-Tetrazole 1htz  
932 C3H3N2- imidizolyl anion im-  
933 C2H3N3 1H-1,2,4-Triazole c288880  
934 C4H4N- pyrrolide anion c4h4n-  
935 C3H4N2 1H-Imidazole 1himidaz  
936 C3H4N2 1H-Pyrazole 1hpyraz  
937 C3H4N2 2H-Imidazole imid2h  
938 C3H4N2 4H-Imidazole imid4h  
939 C4H5N (E)-2-Butenenitrile c627269  
940 C4H5N (Z)-2-Butenenitrile c1190767  
941 C4H5N 2H-pyrrole pyrrole2  
942 C4H5N 3H-pyrrole pyrrole3  
943 C4H5N Cyclopropanecarbonitrile c5500210  
944 C4H5N Pyrrole pyrrole  
945 CH2CHCH2CN Allylcyanide ch2chch2cn  
946 C4H6N+ pyrrole, alpha-protonated appyr  
947 C4H6N+ pyrrole, beta-protonated bppyr  
948 C4H6N+ pyrrole, protonated ppyr  
949 C3H6N2 3-Aminopropionitrile c151188  
950 CH3CH(CH3)CN Propanenitrile, 2-methyl- c4h7n  
951 CH3CH2CH2CN Butanenitrile c109740  
952 C5H8 Bicyclo[2.1.0]pentane c185944  
953 C5H8 Spiropentane c157404  
954 C4H9N Cyclobutylamine cbam  
955 C4H9N Pyrrolidine pyrrolidine  
956 C3H10N2 1,2-Diaminopropane diampr12  
957 C(CH3)3NH2 2-Propanamine, 2-methyl- c75649  
958 C(NH2)H2C(CH3)HCH3 1-Propanamine, 2-methyl- c78819  
959 C(NH2)H2CH2CH2CH3 1-Butanamine butam1  
960 CH3C(NH2)HCH2CH3 2-Butanamine butam2  
961 NH(C2H5)2 diethylamine dea  
962 NC4H12+ tetramethyl ammonium cation nc4h12+  
963 C3O2 Carbon suboxide c3o2  
964 B2O3 diboron trioxide b2o3  
965 MgCO3 Magnesium Carbonate mgco3  
966 BeCO3 Beryllium Carbonate beco3  
967 CaCO3 Calcium Carbonate caco3  
968 ONONO Nitrosyl nitrite onono  
969 PO4--- phosphate po4---  
970 SO4-- sulfate so4--  
971 HOONO2 peroxy nitric acid hoono2  
972 HSO4- bisulfate anion hso4-  
973 C2H2N2S 1,3,4-Thiadiazole c2h2n2s  
974 C3H2O2 Propiolic acid c3h2o2  
975 CHOCOOH oxo acetic acid oaa  
976 CHOOCHO diformyl ether choocho  
977 H2SO4 Sulfuric acid h2so4  
978 H2SeO4 Selenic acid h2seo4  
979 C3H3NO Isoxazole isox  
980 C3H3NO Oxazole oxazole  
981 C3H3NS Thiazole thiazole  
982 CH3C(O)OO acetyl peroxy radical ch3coo2  
983 CH3NO3 Methyl nitrate ch3no3  
984 H3PO4 Phosphoric Acid h3po4  
985 C4H4O Furan furan  
986 C4H4O+ Furan cation furan+  
987 CH3COCCH 3-butyn-2-one c1423605  
988 C4H4S Thiophene furans  
989 C4H4Se selenophene c4h4se  
990 C3H4O2 β–Propiolactone beta  
991 C3H4O2 2-Propenoic acid propenoic2  
992 C3H4O2 Methyl glyoxal megly  
993 C3H4O2 propanedial propanedial  
994 C3H4O2 propenalol propenalol  
995 HOCHCCHOH allenediol aldiol  
996 C2H4O3 1,2,3-trioxolane c2h4o3  
997 C2H4O3 trioxolane124 triox  
998 HOCH2COOH Hydroxyacetic acid hac  
999 CH2CHCONH2 Acrylamide c79061  
1000 CH3OCH2CN Methoxyacetonitrile c1738369  
1001 CH5N3S Hydrazinecarbothioamide c79196  
1002 H2NCH2COOH Glycine glycine  
1003 CH3SO2NH2 methanesulfonamide ch3so2nh2  
1004 C4H6O cis-2-butenal butenal2c  
1005 C4H6O Cyclobutanone cbutone  
1006 C4H6O Furan, 2,3-dihydro- furan23h  
1007 C4H6O Furan, 2,5-dihydro- furan25h  
1008 CH2CHOCHCH2 Vinyl ether vinylether  
1009 CHOCHCHCH3 2-Butenal butenal2  
1010 C4H6S Thiophene, 2,3-dihydro- thiop23h  
1011 C4H6S Thiophene, 2,5-dihydro- thiop25h  
1012 CH2CHSCHCH2 Divinyl sulfide divis  
1013 C2H6N2O Urea, methyl- c598505  
1014 C3H6O2 1,3-Dioxolane dioxolane  
1015 CH3CH2COOH Propanoic Acid propanoic  
1016 CH3COOCH3 methyl acetate aame  
1017 HCOOC2H5 Ethyl formate faee  
1018 C2H6O2S Dimethyl sulfone c67710  
1019 CH3SSSCH3 dimethyl trisulfide c2h6s3  
1020 C3H7NO dimethylformamide dmf  
1021 C3H7NO Propanamide propanam  
1022 C2H3OC2H5 Ethene, ethoxy- c109922  
1023 C4H8O Cyclobutanol c2919235  
1024 C4H8O Furan, tetrahydro- thf  
1025 CH2C(CH3)OCH3 1-Propene, 2-methoxy- pre1meo2  
1026 CH3COCH2CH3 2-Butanone buta2one  
1027 CHOCH(CH3)CH3 Propanal, 2-methyl- c78842  
1028 CHOCH2CH2CH3 Butanal butanal  
1029 C4H8S Thiophene, tetrahydro- tht  
1030 C3H8O2 1,3-Propanediol c504632  
1031 C3H8O2 Hydroperoxide, 1-methylethyl c3031752  
1032 C3H8O2 Methane, dimethoxy- c109875  
1033 C3H8O2 Propylene glycol c57556  
1034 C3H8S2 1,3-Propanedithiol c109808  
1035 C4H10O 1-Butanol butanol1  
1036 C4H10O 1-Propanol, 2-methyl- c78831  
1037 C4H10O 2-Butanol, (.+/-.)- butanol2  
1038 C4H10O Ethanol, 1,1-dimethyl- tbuoh  
1039 C4H10O Ethoxy ethane etoet  
1040 C4H10O Methyl propyl ether meopr  
1041 C4H10O Propane, 2-methoxy- c598538  
1042 C4H10O+ 1-Butanol cation butanol1+  
1043 C(CH3)3SH 2-Propanethiol, 2-methyl- tbush  
1044 C2H5SC2H5 Diethyl sulfide etset  
1045 C4H9SH 1-Butanethiol bush  
1046 CH2(SH)CH(CH3)CH3 1-Propanethiol, 2-methyl- c513440  
1047 CH3C(SCH3)HCH3 Propane, 2-(methylthio)- mesipr  
1048 CH3CH(SH)CH2CH3 2-Butanethiol butansl2  
1049 FNO3 Fluorine nitrate fno3  
1050 ClONO2 Chlorine nitrate clono2  
1051 BrONO2 Bromine nitrate brono2  
1052 TiCl4 Titanium tetrachloride ticl4  
1053 ClO4- perchlorate anion clo4-  
1054 BF4- tetrafluoroboron anion bf4-  
1055 ClFO3 Perchloryl fluoride clfo3  
1056 SO2F2 Sulfuryl fluoride so2f2  
1057 SO2Cl2 Sulfuryl chloride so2cl2  
1058 F3NO Nitrogen trifluoride oxide f3no  
1059 F3PO Phosphoryl fluoride pf3o  
1060 Cl3PO Phosphoryl chloride pcl3o  
1061 CF4 Carbon tetrafluoride cf4  
1062 CF3Cl Methane, chlorotrifluoro- cf3cl  
1063 SiF4 Silicon tetrafluoride sif4  
1064 CF2Cl2 difluorodichloromethane cf2cl2  
1065 TiF4 Titanium tetrafluoride tif4  
1066 CFCl3 Trichloromonofluoromethane cfcl3  
1067 CF3Br Bromotrifluoromethane cf3br  
1068 GeF4 Germanium tetrafluoride gef4  
1069 CCl4 Carbon tetrachloride ccl4  
1070 CCl4+ Carbon tetrachloride cation ccl4+  
1071 SiCl4 Silane, tetrachloro- sicl4  
1072 CBrCl2F bromodichlorofluoromethane cbrcl2f  
1073 CF3I trifluoroiodomethane cf3i  
1074 CBrCl3 Methane, bromotrichloro- cbrcl3  
1075 CBr2F2 Methane, dibromodifluoro- cbr2f2  
1076 GeCl4 Germanium Tetrachloride gecl4  
1077 CBr2ClF dibromochlorofluoromethane cbr2clf  
1078 CBr2Cl2 dibromodichloromethane cbr2cl2  
1079 CCl3I trichloroiodomethane ccl3i  
1080 CFBr3 fluorotribromomethane cfbr3  
1081 CFClBrI fluorochlorobromoiodomethane cfclbri  
1082 CBr3Cl tribromochloromethane cbr3cl  
1083 CF2I2 difluorodiiodomethane cf2i2  
1084 CCl2I2 dichlorodiiodomethane ccl2i2  
1085 SiBr4 Silicon tetrabromide sibr4  
1086 CBr3I tribromoiododmethane cbr3i  
1087 GeBr4 Germanium tetrabromide gebr4  
1088 CI4 tetraiodomethane ci4  
1089 SiI4 silicon tetraiodide sii4  
1090 ClOF3 Chlorine trifluoride oxide clof3  
1091 SF4 Sulfur tetrafluoride sf4  
1092 SeF4 Selenium tetrafluoride sef4  
1093 SCl4 Sulfur tetrachloride scl4  
1094 C2HF3 Trifluoroethylene c2hf3  
1095 CHClCCl2 Trichloroethylene chclccl2  
1096 CHBrCF2 1-Bromo-2,2-difluoroethylene chbrcf2  
1097 HClO4 perchloric acid hclo4  
1098 HSO3F Fluorosulfonic acid hso3f  
1099 CF3OH trifluoromethanol cf3oh  
1100 CH2ClCCCl 1,3-dichloropropyne ch2clcccl  
1101 CHClCCHCl 1,3-dichloroallene chclcchcl  
1102 CHCl2CCH 3,3-dichloropropyne chcl2cch  
1103 PF3CH2 phosphorane, trifluoromethylene- pf3ch2  
1104 CH3CF3 Ethane, 1,1,1-trifluoro- ch3cf3  
1105 CHF2CH2F Ethane, 1,1,2-trifluoro ch2fchf2  
1106 CH3CFCl2 1,1-Dichloro-1-fluoroethane ch3cfcl2  
1107 CH2ClCHCl2 1,1,2-trichloroethane ch2clchcl2  
1108 CH3CCl3 Ethane, 1,1,1-trichloro- ch3ccl3  
1109 SiCl3CH3 methyltrichlorosilane sicl3ch3  
1110 CH3CBr3 1,1,1-tribromoethane ch3cbr3  
1111 NH3BCl3 Amminetrichloroboron nh3bcl3  
1112 SiH3CCl3 (trichloromethyl)silane sih3ccl3  
1113 CH2CClCHCH2 1,3-Butadiene, 2-chloro- c4h5cl  
1114 C3H5ClO Oxirane, (chloromethyl)- c106898  
1115 CH2FCH2CH2F 1,3-difluoropropane ch2fch2ch2f  
1116 CH3CF2CH3 2,2-difluoropropane ch3cf2ch3  
1117 CH2ClCH2CH2Cl 1,3-dichloropropane prdicl13  
1118 CH2ClCHClCH3 Propane, 1,2-dichloro- prdicl12  
1119 CH3CCl2CH3 Propane, 2,2-dichloro- prdicl22  
1120 CHCl2CH2CH3 1,1-dichloropropane prdicl11  
1121 SiCl2(CH3)2 dichlorodimethylsilane sicl2me2  
1122 CH2CClCH2CH3 1-Butene, 2-chloro- bute1cl2  
1123 CH2CHCH2CH2Cl 1-Butene, 4-chloro- bute1cl4  
1124 CH2CHCHClCH3 1-Butene, 3-chloro- bute1cl3  
1125 CH2ClCHCHCH3 2-Butene, 1-chloro- bute2cl1  
1126 CH3CClCHCH3 2-Butene, 2-chloro-, (E)- bute2cl2e  
1127 CH3CClCHCH3 2-Butene, 2-chloro-, (Z)- bute2cl2z  
1128 CHClCHCH2CH3 (E)-1-Chloro-1-butene bute1cl1  
1129 CHClCHCH2CH3 (Z)-1-Chloro-1-butene bute1cl1z  
1130 C4H9F 1-fluorobutane butaf1  
1131 CH3CHFCH2CH3 2-fluorobutane butaf2  
1132 CH2ClCH2CH2CH3 Butane, 1-chloro- butacl1  
1133 CH3CCl(CH3)CH3 Propane, 2-chloro-2-methyl- procl2me2  
1134 CH3CHClCH2CH3 Butane, 2-chloro- butacl2  
1135 XeF4 Xenon tetrafluoride xef4  
1136 C2H2N2O Furazan furazan  
1137 CF3PH2 phosphine, (trifluoromethyl)- cf3ph2  
1138 NH3BF3 Amminetrifluoroboron nh3bf3  
1139 C6H2 hexatriyne c6h2  
1140 C6H4 (E)-Hexa-1,5-diyne-3-ene c6h4e  
1141 C6H4 (Z)-Hexa-1,5-diyne-3-ene c6h4z  
1142 C6H4 Benzyne benzyne  
1143 C6H5- phenyl anion phenyl-  
1144 C6H6 Prismane prismane  
1145 C6H6 1,2,4,5-Hexatetraene ht1245  
1146 C6H6 2,4-Hexadiyne hexadiyne  
1147 C6H6 3,4-Dimethylenecyclobutene cb34m  
1148 C6H6 Benzene benzene  
1149 C6H6 Benzvalene bv  
1150 C6H6 Dewar Benzene dewar  
1151 C6H6 Hexa-1,5-diene-3-yne hdy153  
1152 C6H6 Trimethylenecycopropane tmcp  
1153 C6H6+ Benzene cation c6h6+  
1154 C6H7+ benzene, protonated c6h7+  
1155 C6H8 (E)-hexa-1,3,5-triene c821078  
1156 C6H8 (E)-hexa-2,3,4-triene c59660650  
1157 C6H8 (Z)-hexa-1,3,5-triene hexatri135  
1158 C6H8 (Z)-hexa-2,3,4-triene hetr234c  
1159 C6H8 1,3-Cyclohexadiene cyhexadiene13  
1160 C6H8 1,4-Cyclohexadiene cyhexadiene14  
1161 C6H8 3-Methylenecyclopentene c930267  
1162 C6H8 Bicyclo[2.1.1]hex-2-ene c822413  
1163 C6H8 Bicyclo[2.2.0]hex-1(4)-ene c30830207  
1164 C6H8 Bicyclo[3.1.0]hex-2-ene c694019  
1165 C6H10 1,3-Hexadiene, (E)- hexdi13e  
1166 C6H10 1,3-Hexadiene, (Z)- hexdi13z  
1167 C6H10 1,4-Hexadiene, (E)- hexdi14t  
1168 C6H10 1,4-Hexadiene, (Z)- hexdi14z  
1169 C6H10 1,5-Hexadiene c592427  
1170 C6H10 1-Butyne, 3,3-dimethyl- c917920  
1171 C6H10 1-Hexyne hexyne1  
1172 C6H10 2,4-Hexadiene, (E,E)- hexdi24ee  
1173 C6H10 2,4-Hexadiene, (E,Z)- hexdi24ez  
1174 C6H10 2,4-Hexadiene, (Z,Z)- hexdi24zz  
1175 C6H10 2-Hexyne c764352  
1176 C6H10 3-Hexyne hexyne3  
1177 C6H10 cyclohexene cyclohexene  
1178 C6H10 Cyclopentene, 1-methyl- c693890  
1179 C6H10 Cyclopentene, 3-methyl- c1120623  
1180 C6H10 Cyclopentene, 4-methyl- c1759815  
1181 C4H6(CH3)2 1,1-dimethylcyclobutane dmcb11  
1182 C6H12 (1R,2R)-1,2-dimethylcyclobutane dmcb12t  
1183 C6H12 (1r,3r)-1,3-dimethylcyclobutane dmcb13t  
1184 C6H12 (E)-2-Hexene e2hexene  
1185 C6H12 (E)-3-methylpent-2-ene c616126  
1186 C6H12 (E)-hex-3-ene e3hexene  
1187 C6H12 (Z)-3-methylpent-2-ene c922623  
1188 C6H12 (Z)-hex-2-ene z2hexene  
1189 C6H12 (Z)-hex-3-ene z3hexene  
1190 C6H12 2,3-dimethylbut-1-ene c563780  
1191 C6H12 2,3-dimethyl-but-2-ene tmeet  
1192 C6H12 3-methylenepentane c760214  
1193 C6H12 cis-1,2-dimethylcyclobutane dmcb12c  
1194 C6H12 cis-1,3-dimethylcyclobutane dmcb13c  
1195 C6H12 Cyclohexane cyclohexane  
1196 C6H12 Cyclopentane, methyl- c96377  
1197 C6H12 Ethylcyclobutane c4806615  
1198 C6H12 hex-1-ene hexene1  
1199 C6H14 Butane, 2,2-dimethyl- buta22  
1200 C6H14 Butane, 2,3-dimethyl- buta23  
1201 C6H14 Hexane hexane  
1202 C6H14 Pentane, 2-methyl- penta2  
1203 C6H14 Pentane, 3-methyl- penta3  
1204 C4N2 2-Butynedinitrile c4n2  
1205 N3P3 1,3,5,2,4,6-Triazatriphosphorine n3p3  
1206 C4H2N2 Fumaronitrile c4h2n2  
1207 C2H2N4 sym-tetrazine ttz  
1208 C3H3N3 1,3,5-Triazine triazine135  
1209 CH3N5 5-Aminotetrazole c4418615  
1210 C4H4N2 1,3-Diazine diazine13  
1211 C4H4N2 Pyrazine pyrazine  
1212 C4H4N2 Pyridazine pyridazine  
1213 C4H4N2 Succinonitrile c110612  
1214 C2H4N4 1H-Tetrazole, 1-methyl- c16681779  
1215 C2H4N4 1H-Tetrazole, 5-methyl- c4076362  
1216 C2H4N4 2H-Tetrazole, 2-methyl- c16681780  
1217 C5H5N Bicyclo[1.1.0]butane-1-carbonitrile bibucn  
1218 C5H5N E-2,4-pentadienenitrile bdcn  
1219 C5H5N Pyridine pyridine  
1220 B3N3H6 borazine borazine  
1221 C6H6 Fulvene fulvene  
1222 C5H6N+ Pyridinium c5h6n  
1223 C4H6N2 1H-Imidazole, 2-methyl- c693981  
1224 C5H7N (E)-2-Pentenenitrile c26294984  
1225 C5H7N (E)-3-Pentenenitrile c16529661  
1226 C5H7N (Z)-2-Pentenenitrile c25899507  
1227 C5H7N 1H-Pyrrole, 1-methyl- c96548  
1228 C5H7N Cyclobutanecarbonitrile c4426113  
1229 C5H9N 1,2,3,6-Tetrahydropyridine c694053  
1230 C5H9N Butanenitrile, 2-methyl- c18936179  
1231 C5H9N Pentanenitrile c110598  
1232 C5H9N Propanenitrile, 2,2-dimethyl- c630182  
1233 C6H10 Bicyclo[3.1.0]hexane c285585  
1234 C5H11N Cyclopentanamine cypentam  
1235 C5H11N Piperidine piper  
1236 C4H12N2 1,2-Butanediamine c4426486  
1237 C4H12N2 2-Methyl-1,2-propanediamine c811938  
1238 Li2CO3 Lithium Carbonate li2co3  
1239 Na2CO3 Sodium Carbonate na2co3  
1240 C2O4-- oxalate anion c2o4  
1241 MgSO4 Magnesium Sulfate mgso4  
1242 N2O4 Dinitrogen tetroxide n2o4  
1243 C3H2O3 vinylene carbonate vica  
1244 C2H2O4 Oxalic Acid oxalic  
1245 C2H3NO3 Oxamic acid oxamic  
1246 C4H4O2 2(5H)-Furanone furanone  
1247 C4H4O2 2-Oxetanone, 4-methylene- c674828  
1248 C2H4N2O2 Oxalamide oxalamide  
1249 C2H4N2S2 Ethanedithioamide c79403  
1250 C2H4CO3 Ethylene carbonate etco3  
1251 C3H4O2S 2H-Thiete-1,1-dioxide c7285327  
1252 C3H4S3 1,3-Dithiolane-2-thione c822388  
1253 C2H4O4 Formic acid dimer fadimer  
1254 C4H5NO 3-Methylisoxazole isox3m  
1255 C4H5NO Isoxazole, 5-methyl- c5765446  
1256 C4H5NS 4-Methylthiazole c693958  
1257 C2H5NO3 Nitric acid, ethyl ester c625581  
1258 C5H6O 2H-Pyran pyran2  
1259 C5H6O 2-methylfuran furan2m  
1260 C5H6O 3-Methylfuran furan3m  
1261 C5H6O Pentadienal pdal  
1262 C5H6S Thiophene, 2-methyl- c554143  
1263 C5H6S Thiophene, 3-methyl- c616444  
1264 C4H6O2 γ–Butyrolactone c96480  
1265 C4H6O2 2,3-Butanedione c431038  
1266 C4H6O2 2-Propenoic acid, methyl ester c96333  
1267 C4H6O2 Crotonic Acid crot  
1268 C4H6OS 2,3-dihydrothiophene-2-ol c9000117  
1269 C4H6OS 2,5-dihydrothiophene-3-ol c9000093  
1270 C4H6OS 4,5-dihydrothiophene-2-ol c9000106  
1271 C4H6OS 4,5-dihydrothiophene-3-ol c9000082  
1272 C4H6OS Dihydro-2-(3H)-thiophenone c1003107  
1273 C4H6OS Dihydro-3-(2H)-thiophenone c1003049  
1274 C4H6OS Vinyl sulfoxide c1115157  
1275 CH6N4S Carbonothioic dihydrazide thiacarb  
1276 C2H6N2O2 (E)-Azodioxymethane c37765154  
1277 C2H6N2O2 Dimethylnitroamine c4164287  
1278 C3H6O3 1,3,5-Trioxane trioxane  
1279 C3H6S3 1,3,5-Trithiane c3h6s3  
1280 C3H6S3 Carbonotrithioic acid, dimethyl ester c2314489  
1281 C2H6O3S Sulfurous acid, dimethyl ester c616422  
1282 C4H7NO 2-Pyrrolidinone c616455  
1283 C4H7NO Ethoxyacetonitrile etoaccn  
1284 C4H7NO Methacrylamide c79390  
1285 C4H7NO Oxazole, 4,5-dihydro-2-methyl- c1120645  
1286 HCONH2CN2H4 formamide aminomethanimine dimer d13  
1287 C3H7ONO Propyl nitrite prono  
1288 CH3CH(CH3)ONO Isopropyl nitrite c541424  
1289 CH3CH(NH2)COOH Alanine alanine  
1290 CH3NHCH2COOH Sarcosine sarcosine  
1291 NH2CH2CH2COOH β–alanine betaalanine  
1292 NH2COOC2H5 Urethane urethane  
1293 C5H8O 2H-Pyran, 3,4-dihydro- c110872  
1294 C5H8O Cyclopentanone c120923  
1295 C5H8O Furan, 2,3-dihydro-5-methyl- c1487156  
1296 C5H8O Methyl cyclopropyl ketone c765435  
1297 N(CH3)2CONH2 Urea, N,N-dimethyl- c598947  
1298 NH(CH3)CONH(CH3) Urea, N,N'-dimethyl- c96311  
1299 NH2CONHC2H5 Urea, ethyl- c625525  
1300 C4H8O2 1,3-Dioxane dioxan13  
1301 C4H8O2 1,3-Dioxolane, 2-methyl- c497267  
1302 C4H8O2 1,4-Dioxane dioxan14  
1303 C4H8O2 Ethene, 1,1-dimethoxy- c922690  
1304 C4H8O2 Ethyl acetate c141786  
1305 C4H8OS s-Ethyl thioacetate c625605  
1306 C3H8O3 1,2,3-Propanetriol glycerin  
1307 C3H8O2S (Methylsulfonyl)ethane c594434  
1308 C4H9NO Butanamide c541355  
1309 C4H9NO Propanamide, 2-methyl- c563837  
1310 C5H10O 2-Butanone, 3-methyl- c563804  
1311 C5H10O 2H-Pyran, tetrahydro- c142687  
1312 C5H10O 2-methylbutyraldehyde 2meba  
1313 C5H10O 2-Pentanone mpk  
1314 C5H10O 3-Pentanone dek  
1315 C5H10O Cyclopentanol c96413  
1316 C5H10O Oxetane, 3,3-dimethyl- c6921353  
1317 C5H10O Pentanal pal  
1318 C5H10S 2H-Thiopyran, tetrahydro- c1613510  
1319 C5H10S 3-Ethylthio-1-propene c5296628  
1320 C5H10S Cyclopentanethiol c1679078  
1321 C5H10S Thiophene, tetrahydro-2-methyl- c1795091  
1322 C5H10S Thiophene, tetrahydro-3-methyl- c4740005  
1323 C4H10O2 1,1-Dimethoxyethane c534156  
1324 C4H10O2 1,3-Butanediol budiol13  
1325 C4H10O2 1,4-Butanediol budiol14  
1326 C4H10O2 Ethane, 1,2-dimethoxy- c110714  
1327 C4H10OS Diethyl sulfoxide c70291  
1328 C4H10S2 1,4-Butanedithiol budisl14  
1329 C4H11NO Diethylhydroxylamine c3710847  
1330 C5H12O 1-Butanol, 2-methyl- c137326  
1331 C5H12O 1-Butanol, 3-methyl- c123513  
1332 C5H12O 1-Pentanol pentanol1  
1333 C5H12O 2-Butanol, 3-methyl- c598754  
1334 C5H12O 2-Pentanol peol2  
1335 C5H12O 3-Pentanol pentan3ol  
1336 C5H12O Butane, 1-methoxy- meobu  
1337 C5H12O Propane, 1-ethoxy- proet  
1338 C5H12O Propane, 2-methoxy-2-methyl- c1634044  
1339 C5H12S 1-Butanethiol, 2-methyl- c1878188  
1340 C5H12S 1-Butanethiol, 3-methyl- c541311  
1341 C5H12S 1-Pentanethiol c110667  
1342 C5H12S 1-Propanethiol, 2,2-dimethyl- c1679089  
1343 C5H12S 2-Butanethiol, 2-methyl- c1679090  
1344 C5H12S 2-Butanethiol, 3-methyl- c2084186  
1345 C5H12S Butane, 1-(methylthio)- c628295  
1346 C5H12S Ethyl propyl sulfide c4110503  
1347 C5H12S Propane, 2-(ethylthio)- c5145993  
1348 C5H12S Propane, 2-methyl-2-(methylthio)- c6163640  
1349 C4F2 difluorobutadiyne c4f2  
1350 ClCOClCO Oxalyl chloride oxcl  
1351 CF3CN Acetonitrile, trifluoro- cf3cn  
1352 CF3CN+ Acetonitrile, trifluoro- cation cf3cn+  
1353 B2F4 Diboron tetrafluoride b2f4  
1354 B2Cl4 Diboron tetrachloride b2cl4  
1355 C2F4 Tetrafluoroethylene c2f4  
1356 C2F4+ Tetrafluoroethylene cation c2f4+  
1357 C2ClF3 Ethene, chlorotrifluoro- c2f3cl  
1358 CF2CCl2 difluorodichloroethylene cf2ccl2  
1359 CFClCClF trans-1,2-dichloro-1,2-difluoroethylene cfclcclf  
1360 CFClCFCl cis-1,2-dichloro-1,2-difluoroethylene cfclcfcl  
1361 C2FCl3 fluorotrichloroethene c2fcl3  
1362 C2Cl4 Tetrachloroethylene c2cl4  
1363 C2Br4 tetrabromoethene c2br4  
1364 CF3OF Trifluoromethylhypofluorite cf3of  
1365 SiF5- silicon pentafluoride anion sif5-  
1366 SOF4 Sulfur tetrafluoride oxide sof4  
1367 PF5 Phosphorus pentafluoride pf5  
1368 AsF5 Arsenic pentafluoride asf5  
1369 PCl5 Phosphorus pentachloride pcl5  
1370 SF5+ pentafluoro sulfur cation sf5+  
1371 SbCl5 Antimony pentachloride sbcl5  
1372 BrF5 bromine pentafluoride brf5  
1373 ClF5 chlorinepentafluoride clf5  
1374 IF5 pentafluoroiodine if5  
1375 CHFClCHClF ethane, 1,2-dichloro-1,2-difluoro- chfclchclf  
1376 CF3CH2F 1,1,1,2-tetrafluoroethane cf3ch2f  
1377 CHF2CHF2 1,1,2,2-tetrafluoroethane chf2chf2  
1378 CHFClCHFCl 1,2-dichloro-1,2-difluoroethane RR chfclchfcl  
1379 CH2ClCCl3 1,1,1,2-tetrachloroethane ch2clccl3  
1380 CHCl2CHCl2 Ethane, 1,1,2,2-tetrachloro- chcl2chcl2  
1381 CH2BrCBr3 1,1,1,2-tetrabromo ethane c2h2br4  
1382 CHCl2CHF2 1,1-dichloro-2,2-difluoroethane c2h2cl2f2  
1383 CF3COOH trifluoroacetic acid cf3cooh  
1384 C4H3ClO Furan, 2-chloro fur2cl  
1385 C4H3ClO Furan,3-chloro fur3cl  
1386 C3H5ClO2 Carbonochloridic acid, ethyl ester c541413  
1387 C3H5Cl3 Propane, 1,2,3-trichloro- prcl135  
1388 C4H8Cl2 1,4-Dichlorobutane c110565  
1389 C4H8Cl2 Butane, 1,2-dichloro- c616217  
1390 C4H8Cl2 Butane, 1,3-dichloro- c1190223  
1391 C4H8Cl2 Butane, 2,3-dichloro-, (r*,r*)-(.+/-.)- c2211678  
1392 C4H8Cl2 Butane, 2,3-dichloro-, (r*,s*)- c4028562  
1393 C4H9ClO 1-Chloro-2-ethoxyethane c628342  
1394 C5H11Cl Pentane, 1-chloro- pencl1  
1395 C4H8O2 Butanoic acid bua  
1396 C7H7+ cycloheptatrienyl cation c7h7+  
1397 C6H5CH3 toluene toluene  
1398 C7H8 cycloheptatriene cht  
1399 C7H8 Norbornadiene norbor  
1400 C7H8 Quadricyclane qucy  
1401 C7H12 Norbornane nor  
1402 C7H14 cycloheptane c7h14  
1403 C7H16 2-methylhexane 2mhex  
1404 C7H16 3-methylhexane hex3m  
1405 C7H16 heptane heptane  
1406 CH(CN)3 tricyanomethane mecn3  
1407 HN=C=C(CN)2 Dicyanoketenimine c4hn3  
1408 C6H7N 2-Methylpyridine mp  
1409 C6H5NH2 aniline aniline  
1410 C6H15N triethylamine tea  
1411 N2O5 Dinitrogen pentoxide n2o5  
1412 C4H2O3 Maleic Anhydride malan  
1413 C5H4O2 4-Cyclopentene-1,3-dione cpdio  
1414 C5H4O2 furfural furfural  
1415 C5H5NO 2(1H)-Pyridinone c72762006  
1416 C5H5NO 2(3H)-Pyridinone c9000048  
1417 C5H5NO 2(5H)-Pyridinone c9000037  
1418 C5H5NO 2-Pyridinol c109104  
1419 C5H5NO 3(2H)-Pyridinone c9000004  
1420 C5H5NO 3(4H)-Pyridinone c9000026  
1421 C5H5NO 3(6H)-Pyridinone c9000015  
1422 C5H5NO 3-Pyridinol c109002  
1423 C5H5NO 4(1H)-Pryidinone c9000060  
1424 C5H5NO 4(3H)-Pryidinone c9000059  
1425 C5H5NO 4-Pyridinol c626642  
1426 C6H5OH phenol phenol  
1427 C6H6O 2,4-Cyclohexadienone c24599573  
1428 C6H6O 2,5-Cyclohexadienone c5664335  
1429 C6H5SH Benzenethiol phsh  
1430 HO2CCHNH2CH2OH Serine serine  
1431 C5H8O2 Acetylacetone acac  
1432 C4H8O2S Sulfolane sulfolane  
1433 C7H10 Norbornene norbornene  
1434 CH(C2H3)3 trivinyl methane tvm  
1435 C6H10O cyclohexanone chexo  
1436 C6H12O hexanal c6h12o  
1437 C6H12O Oxepane oxepane  
1438 C3H7OC3H7 di-n-propyl ether propr  
1439 F2CCCF2 tetrafluoroallene pfa  
1440 CF3COO- trifluoro acetate anion cf3coo-  
1441 CF3COF trifluoroacetyl fluoride cf3cof  
1442 CF3COCl trifluoroacetyl chloride cf3cocl  
1443 PF6- Hexafluorophosphate ion pf6-  
1444 SF6 Sulfur Hexafluoride sf6  
1445 SeF6 Selenium hexafluoride sef6  
1446 SF5Cl sulfur chloropentafluoride sf5cl  
1447 CF3CHF2 pentafluoroethane cf3chf2  
1448 CF3CHFCl 1,1,1,2-tetrafluorochloroethane cf3chfcl  
1449 CF3CHCl2 1,1-Dichloro-2,2,2-trifluoroethane cf3chcl2  
1450 CHCl2CClF2 Ethane, 1,2,2-trichloro-1,1-difluoro- chcl2cclf2  
1451 CCl3CHCl2 pentachloroethane ccl3chcl2  
1452 C6H5F Fluorobenzene bzf  
1453 C6H5Cl chlorobenzene bzcl  
1454 C6H5Br bromobenzene bzbr  
1455 C8H6 Calicene calicene  
1456 C6H5CCH phenylacetylene phac  
1457 C8H6 benzocyclobutadiene bcbd  
1458 C8H6 Pentalene pentalene  
1459 C6H5CHCH2 Styrene styrene  
1460 C8H8 cubane cubane  
1461 C8H8 cyclooctatetraene cot  
1462 C6H5CH2CH3 Ethylbenzene etbz  
1463 CH3C6H4CH3 meta-xylene mxylene  
1464 CH3C6H4CH3 paraxylene pxylene  
1465 C8H14 Bicyclo[2.2.2]octane bico222  
1466 C8H16 cyclooctane cyclooct  
1467 (CH3)3CC(CH3)3 tetramethylbutane tmb  
1468 C8H18 Octane c8h18  
1469 C6H5CN phenyl cyanide phcn  
1470 C6H12N2 Triethylenediamine ted  
1471 C4O4-- squarate dianion c4o4--  
1472 S4N4 Tetrasulfur tetranitride s4n4  
1473 S8 Octasulfur s8  
1474 C6H4O2 parabenzoquinone pbq  
1475 C4H4N2O2 Uracil uracil  
1476 C6H5CHO benzaldehyde benzal  
1477 C6H5OCH3 Anisole anisole  
1478 C5H9NO2 Proline proline  
1479 C4F4 tetrafluorcyclobutadiene c4f4  
1480 Al2Cl6 Aluminum, di-μ-chlorotetrachlorodi- al2cl6  
1481 CF3CFCl2 1,1-Dichlorotetrafluoroethane cf3cfcl2  
1482 CF2ClCFCl2 Ethane, 1,1,2-trichloro-1,2,2-trifluoro- cf2clcfcl2  
1483 CF3CCl3 1,1,1-trifluoro-2,2,2-trichloroethane cf3ccl3  
1484 C2F6 hexafluoroethane c2f6  
1485 C2Cl6 hexachloroethane c2cl6  
1486 IF7 Iodine heptafluoride if7  
1487 C6H4F2 metadifluorobenzene mdfb  
1488 C6H4F2 orthodifluorobenzene odfb  
1489 C6H4F2 1,4-difluorobenzene pdfb  
1490 C6H4Cl2 1,2-dichlorobenzene dcb12  
1491 C6H4Cl2 1,3-dichlorobenzene dcb13  
1492 C6H4Cl2 1,4-dichlorobenzene dcb14  
1493 C6H5NO nitrosobenzene bzno  
1494 C9H8 Indene indene  
1495 C9H8 spiro[4.4]nona-1,3,6,8-tetraene snt  
1496 C9H12 n-propyl benzene prbz  
1497 C9H20 Nonane nonane  
1498 C(CN)4 tetracyanomethane c5n4  
1499 C5H4N4 purine purine  
1500 C8H7N Indole indole  
1501 C3H3N3O3 cyanuric acid cyanuric  
1502 C6H5NO2 Nitrobenzene c6h5no2  
1503 C6H5COOH benzoic acid benzo  
1504 CH3COC6H5 acetophenone acph  
1505 C3Cl3N3 1,3,5-Triazine, 2,4,6-trichloro- c3cl3n3  
1506 C3F6 hexafluoropropene c3f6  
1507 C6H3F3 Benzene trifluoride 123 bzf3a  
1508 C8H18O 1-Octanol octanol  
1509 C10H8 Azulene azu  
1510 C10H8 naphthalene naph  
1511 C10H10 bullvalene bullv  
1512 C10H16 adamantane adamantane  
1513 C6N4 Tetracyanoethylene tcne  
1514 C10H22 Decane decane  
1515 C4F6 perfluorobutadiene c4f6  
1516 SF5CF3 Sulfur, pentafluoro(trifluoromethyl)- sf5cf3  
1517 C3F8 perfluoropropane c3f8  
1518 Fe(CO)5 Iron pentacarbonyl ipc  
1519 Fe(C5H5)2 ferrocene fecp2  
1520 B12H12-- Dodecahydrododecaborate(2-) b12h12--  
1521 B12H12-- Dodecahydrododecaborate(2-) b12h12--  
1522 C12H8 Acenaphthylene acenaph  
1523 C12H8 biphenylene biph  
1524 C12H10 biphenyl biphenyl  
1525 C12H10 Heptalene heptalene  
1526 C6H12O6 Inositol inositol  
1527 C6F6 hexafluorobenzene c6f6  
1528 S2F10 disulphur decafluoride s2f10  
1529 C13H10 Fluorene fluorene  
1530 C14H10 Anthracene anth  
1531 C14H10 Phenanthrene phenanthrene  
1532 C14H14 Bibenzyl bibenzyl  
1533 C12H10N2 azobenzene azobenzene  
1534 C6H5COC6H5 benzophenone benzophenone  
1535 C16H10 Pyrene pyrene  
1536 C18H12 Tetracene tetracene  
1537 C19H16 Triphenylmethane tpm  
1538 C24H12 Coronene coronene  
1539 C60 Buckminsterfullerene c60