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List of which calculations are completed at ROHF /cc-pVDZ

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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 LiH+ lithium hydride cation 2ΣC∞v
17 NaH+ sodium hydride cation 2ΣC∞v
18 Be+ Beryllium atom cation 2SKh
19 Mg- Magnesium atom anion 2PKh
20 Mg+ Magnesium atom cation 2SKh
21 BeH beryllium monohydride 2ΣC∞v
22 MgH magnesium monohydride 2ΣC∞v
23 CaH Calcium monohydride 2ΣC∞v
24 TiH Titanium monohydride 4ΦC∞v
25 BeH2+ Beryllium dihydride cation 2ΣC∞v
26 BeH2+ Beryllium dihydride cation 2ΣuD∞h
27 BeH2+ Beryllium dihydride cation   
28 B Boron atom 2PKh
29 B Boron atom 4PKh
30 B+ Boron atom cation 1SKh
31 Al Aluminum atom 2PKh
32 Al- Aluminum atom anion 3PKh
33 Al+ Aluminum atom cation 1SKh
34 Sc Scandium atom 2DKh
35 Sc+ Scandium cation 3DKh
36 Ga Gallium atom 2P 
37 Ga- Gallium atom anion 3POh
38 Ga+ Gallium atom cation 1S 
39 BH Boron monohydride 3ΠC∞v
40 BH- boron monohydride anion 4ΣC∞v
41 ScH+ Scandium monohydride cation 2ΣC∞v
42 GaH+ Gallium monohydride cation 2ΣC∞v
43 BH2 boron dihydride 2A1C2v
44 BH2- boron dihydride anion 3B1C2v
45 AlH2 aluminum dihydride 2A1C2v
46 AlH2- aluminum dihydride anion 1A1C2v
47 AlH2+ aluminum dihydride cation 1ΣgD∞h
48 BH3+ boron trihydride cation 2E'D3h
49 BH3+ boron trihydride cation 2B2C2v
50 BH3+ boron trihydride cation  C2v
51 AlH3- aluminum trihydride anion 2A2"D3h
52 AlH3- aluminum trihydride anion  C3v
53 AlH3+ aluminum trihydride cation 2ED3h
54 AlH3+ aluminum trihydride cation 2A1C2v
55 BH4 borohydride 2B2C2v
56 BH4- borohydride anion 1A1Td
57 C Carbon atom 3P0Kh
58 C- Carbon atom anion 2DKh
59 C+ Carbon atom cation 2PKh
60 Si Silicon atom 3PKh
61 Si- Silicon atom anion 4SKh
62 Si+ Silicon atom cation 2PKh
63 Ge Germanium atom 3PKh
64 Ge- Germanium anion 4SKh
65 Ge+ Germanium cation 2PKh
66 CH Methylidyne 2Π1/2C∞v
67 SiH Silylidyne 2ΠC∞v
68 SiH- silicon monohydride anion 3ΣC∞v
69 GeH germylidene 2ΠC∞v
70 CH2 Methylene 3B1C2v
71 CH2 Methylene 3ΣGD∞h
72 CH2- methylene anion 2B1C2v
73 CH2+ methylene cation 2A1C2v
74 CH2+ methylene cation 2ΠD∞h
75 SiH2 silicon dihydride 3B1C2v
76 SiH2- silicon dihydride anion 2B1C2v
77 SiH2+ silicon dihydride cation 2A1C2v
78 GeH2 germylene 1A1C2v
79 GeH2- germylene anion 2B1C2v
80 CH3 Methyl radical 2A1D3h
81 CH3- methyl anion 1A1C3v
82 CH3+ methyl cation 1A1'D3h
83 SiH3 Silyl radical 2A1C3v
84 SiH3- Silyl anion 1A1C3v
85 SiH3+ Silyl cation 1A1'D3h
86 GeH3 Germyl radical 2A1C3v
87 GeH3+ germyl cation 1A1'D3h
88 N Nitrogen atom 4SKh
89 N- Nitrogen atom anion 3SKh
90 N+ Nitrogen atom cation 3PKh
91 P Phosphorus atom 4SKh
92 P- Phosphorus atom anion 3PKh
93 P+ Phosphorus atom cation 3PKh
94 V Vanadium atom 4FKh
95 V+ Vanadium atom cation 5DKh
96 As Arsenic atomic 4SKh
97 As- Arsenic anion 3PKh
98 As+ Arsenic cation 3PKh
99 NH Imidogen 3Σ-C∞v
100 PH phosphorus monohydride 3Σ-C∞v
101 AsH Arsenic monohydride 3ΣC∞v
102 AsH+ Arsenic monohydride cation 2ΠC∞v
103 ND2 Amidogen-d2 2B1C2v
104 NH2 Amino radical 2B1C2v
105 NH2+ Amino cation 3B1C2v
106 PH2 Phosphino radical 2B1C2v
107 PH2- Phosphino anion 1A1C2v
108 PH2+ Phosphino cation 1A1C2v
109 AsH2 Arsenic dihydride 2A1C2v
110 NH3- Ammonia anion 2A1C3v
111 NH3+ ammonia cation 2A2"D3h
112 PH3+ Phosphine cation 2A1C3v
113 AsH3+ Arsine cation 2A1C3v
114 NH4 Ammonium radical   
115 PH4 Phosphoranyl radical   
116 O Oxygen atom 3SKh
117 O- Oxygen atom anion 2PKh
118 O+ Oxygen atom cation 4SKh
119 S Sulfur atom 3PKh
120 S- Sulfur atom anion 2PKh
121 S+ Sulfur atom cation 4SKh
122 Se Selenium atom 3PKh
123 Se- Selenium atom anion 2PKh
124 Se+ Selenium atom cation 4SKh
125 DO Hydroxyl-d 2ΠC∞v
126 OH Hydroxyl radical 2ΠC∞v
127 OH+ hydoxyl cation 3ΣC∞v
128 DS Mercapto-d 2ΠC∞v
129 HS Mercapto radical 2ΠC∞v
130 HS- mercapto anion 1ΣC∞v
131 HS+ sulfur monohydride cation 3ΣC∞v
132 CrH Chromium hydride 6ΣC∞v
133 CrH+ Chromium hydride cation 5ΣC∞v
134 HSe Selenium monohydride 2ΠC∞v
135 HSe+ selenium monohydride cation 3ΣC∞v
136 H2O- water anion 2A1C2v
137 H2O- water anion 2A'Cs
138 H2O+ water cation 2B1C2v
139 H2S- Hydrogen sulfide anion 2A'Cs
140 H2S+ Hydrogen sulfide cation 2B1C2v
141 H2Se Hydrogen selenide 1A1C2v
142 H2Se+ Hydrogen selenide cation 2B1C2v
143 H3S+ Sulfonium cation 1A1C3v
144 F Fluorine atom 2PKh
145 F- Fluorine atom anion 1SKh
146 F+ Fluorine atom cation 3SKh
147 F+ Fluorine atom cation 1DKh
148 Cl Chlorine atom 2PKh
149 Cl- Chlorine atom anion 1SKh
150 Cl+ Chlorine atom cation 3PKh
151 Cl+ Chlorine atom cation 1DKh
152 Br Bromine atom 2PKh
153 Br- Bromine atom anion 1SKh
154 Br+ Bromine atom cation 3PKh
155 HF- hydrogen fluoride anion 2ΣC∞v
156 HF+ hydrogen fluoride cation 2ΠC∞v
157 HCl- hydrogen chloride anion 2ΣC∞v
158 HCl+ hydrogen chloride cation 2ΠC∞v
159 HBr hydrogen bromide 1ΣC∞v
160 HBr- hydrogen bromide anion 2ΣC∞v
161 HBr+ hydrogen bromide cation 2ΠC∞v
162 H2Cl+ dihydrogen monochloride cation 1A1C2v
163 Ne Neon atom   
164 Ne- Neon atom anion 2SKh
165 Ne+ Neon atom cation 2PKh
166 Ar- Argon atom anion 2SKh
167 Ar+ Argon atom cation 2PKh
168 Kr+ Krypton cation 2PKh
169 NeH neon hydrogen 2ΣC∞v
170 ArH+ Argon hydride cation 1ΣC∞v
171 Na2- sodium diatomic anion 2ΣuD∞h
172 Na2+ sodium diatomic cation 2ΣgD∞h
173 LiBe Lithium Beryllium 2ΣC∞v
174 LiMg Lithium magnesium 2ΣC∞v
175 NaBe Sodium Beryllium 2ΣC∞v
176 NaMg Sodium Magnesium 2ΣC∞v
177 Be2 Beryllium diatomic 3ΠgD∞h
178 Be2- Beryllium diatomic anion 2ΠuD∞h
179 LiB Lithium boride 3ΠC∞v
180 BeB Beryllium monoboride 2ΠC∞v
181 B2 Boron diatomic 3ΣgD∞h
182 B2 Boron diatomic 5ΣuD∞h
183 B2+ Boron diatomic cation 2ΠD∞h
184 BAl Boron Aluminum 3ΣC∞v
185 BGa Boron Gallium 3ΣC∞v
186 AlGa Aluminum Gallium 3ΣC∞v
187 Ga2 Gallium diatomic 3Piu 
188 HBBH Diborane(2) 3ΣGD∞h
189 B2H6+ Diborane cation   
190 LiC Lithium Carbide 4ΣC∞v
191 BeC Beryllium Carbide 3Σ-C∞v
192 BeC Beryllium Carbide   
193 CaC Calcium monocarbide   
194 BC boron monocarbide 4Σ-C∞v
195 BC- boron monocarbide anion 3ΠuC∞v
196 AlC Aluminum carbide 4ΣC∞v
197 BSi Boron silicide 4ΣC∞v
198 BSi Boron silicide 2ΣC∞v
199 C2 Carbon diatomic 3ΠuD∞h
200 C2+ carbon diatomic cation 4ΣgD∞h
201 SiC silicon monocarbide 3ΣC∞v
202 SiC- silicon monocarbide anion 2ΣgC∞v
203 SiC+ silicon monocarbide cation 2ΠC∞v
204 Si2 Silicon diatomic 3ΣgD∞h
205 GeC Germanium monocarbide 1ΣC∞v
206 SiGe Silicon Germanium   
207 Ge2 Germanium diatomic 3ΣgD∞h
208 Ge2 Germanium diatomic 1ΣGD∞h
209 C2H Ethynyl radical 2ΣC∞v
210 C2H2+ acetylene cation 2ΠuD∞h
211 C2H2+ acetylene cation   
212 CCH2 vinylidene 1A1C2v
213 CCH2 vinylidene 3B2C2v
214 H2CC- vinylidene anion   
215 HCCH- acetylene anion   
216 HCCH- acetylene anion   
217 CH3Li methyl lithium 1A1C3v
218 C2H3 vinyl 2A'Cs
219 C2H3+ vinyl cation 1A1C2V bridging H
220 C2H4- Ethylene anion 2B2gD2h
221 C2H4- Ethylene anion 2AgC2h
222 C2H4+ Ethylene cation 2B3uD2h
223 C2H4+ Ethylene cation 2B3D2
224 CH3CH methylmethylene 3A"Cs
225 C2H5 Ethyl radical 2A'Cs
226 C2H6+ ethane cation 2BgC2h
227 C2H6+ ethane cation 2AgCi
228 LiN Lithium Nitride 3ΣC∞v
229 LiN+ Lithium Nitride cation 4ΣC∞v
230 LiP Lithium monophosphide   
231 BeN Beryllium mononitride 4ΣC∞v
232 BeN Beryllium mononitride 2ΠC∞v
233 BeN- Beryllium mononitride anion 1ΣC∞v
234 BeN+ Beryllium mononitride cation 1ΣC∞v
235 MgN Magnesium Nitride   
236 MgN Magnesium Nitride   
237 BP Boron monophosphide 3ΠC∞v
238 AlP Aluminum monophosphide 3ΣC∞v
239 AlP Aluminum monophosphide 3ΠC∞v
240 GaN Gallium mononitride 3ΠC∞v
241 GaP Gallium monophosphide 3ΣC∞v
242 GaAs Gallium arsenide 3Π 
243 GaAs Gallium arsenide 1Σ 
244 BN boron nitride 3ΠC∞v
245 AlN Aluminum nitride 3ΠiC∞v
246 CN Cyano radical 2ΣC∞v
247 CP Carbon monophosphide 2ΣC∞v
248 SiN Silicon nitride 2ΣC∞v
249 SiP Silicon monophosphide 2ΠC∞v
250 SiP- Silicon monophosphide anion 1ΣC∞v
251 SiP+ Silicon monophosphide cation 3ΣC∞v
252 N2 Nitrogen diatomic   
253 N2- nitrogen diatomic anion 2ΠgD∞h
254 N2+ diatomic nitrogen cation 2ΣgD∞h
255 HNB hydrogen nitrogen boron 2ΣC∞v
256 HCN+ hydrogen cyanide cation 2ΠC∞v
257 HNC+ hydrogen isocyanide cation   
258 HCP+ Phosphaethyne cation   
259 NNH Dinitrogen monohydride 2A'Cs
260 HPO+ Hydrogen phosphorus oxide cation 2A'Cs
261 CNH2 Aminomethylidyne radical 2B2C2v
262 H2CN Dihydrogen cyanide radical 2B2C2v
263 H2CN+ hydrocyanonium cation 1A1C2v
264 HCNH methyleneazane 2A'CS cis
265 HCNH methyleneazane 2A'CS trans
266 N2H2+ trans-diazene cation 2AGC2h
267 CH2NH+ Methanimine cation   
268 CHNH2+ Aminocarbene cation   
269 N2H4+ hydrazine cation 2AGC2h
270 CH3NH2+ methyl amine cation 2A'Cs
271 CH3NH3 methyl ammonium radical 2A1C3v
272 LiO lithium oxide 2ΣC∞v
273 LiO- lithium oxide anion 1ΣC∞v
274 LiO- lithium oxide anion 3ΣC∞v
275 LiO+ lithium oxide cation 3ΣC∞v
276 LiS Lithium monosulfide 2ΠC∞v
277 LiS+ Lithium sulfide cation 3ΣC∞v
278 NaO sodium monoxide 2ΣC∞v
279 NaS Sodium sulfide 2ΠC∞v
280 LiSe Lithium monoselenide   
281 BeO- Beryllium monoxide anion 2ΣC∞v
282 BeO+ Beryllium monoxide cation 2ΠC∞v
283 BO boron monoxide 2ΣC∞v
284 BO- boron monoxide anion 1ΣC∞v
285 AlO Aluminum monoxide 2ΣC∞v
286 BS boron sulfide 2ΣC∞v
287 AlS Aluminum sulfide 2ΣC∞v
288 ScO Scandium monoxide 2ΣC∞v
289 GaO Gallium monoxide 2ΣC∞v
290 GaS Gallium monosulfide   
291 CO Carbon monoxide 3ΠC∞v
292 CO- carbon monoxide anion 2ΠC∞v
293 CO+ carbon monoxide cation 2ΣC∞v
294 TiO Titanium monoxide 3ΔC∞v
295 GeO+ Germanium monoxide cation 2ΣC∞v
296 SiSe+ Silicon Monoselenide cation   
297 NO Nitric oxide 2ΠC∞v
298 NO- nitric oxide anion 3ΣC∞v
299 NS Mononitrogen monosulfide 2ΠC∞v
300 NS- nitrogen sulfide anion 3ΣC∞v
301 PO Phosphorus monoxide 2ΠC∞v
302 PS phosphorus sulfide 2ΣC∞v
303 VO Vanadium monoxide 4Σ- 
304 AsO Arsenic monoxide 2ΠC∞v
305 NSe Nitrogen monoselenide 2ΠC∞v
306 AsS Arsenic monosulfide 2ΠC∞v
307 PSe Phosphorus monoselenide 2ΠC∞v
308 AsSe Arsenic monoselenide 2ΠC∞v
309 O2 Oxygen diatomic 3ΣgD∞h
310 O2- oxygen diatomic anion 2ΠD∞h
311 O2+ diatomic oxygen cation 2ΠgD∞h
312 SO Sulfur monoxide 3ΣC∞v
313 SO Sulfur monoxide 1ΣC∞v
314 SO+ sulfur monoxide cation 2ΠC∞v
315 S2 Sulfur diatomic 3ΣgD∞h
316 SeO Selenium monoxide 3ΣC∞v
317 Se2 Selenium diatomic 3ΣgD∞h
318 BeOH beryllium monohydroxide 2A'Cs
319 BeOH beryllium monohydroxide 2ΣC∞v
320 COH Hydroxymethylidyne   
321 HCO Formyl radical 2A'Cs
322 HCO- formyl anion 1A'Cs
323 HCO+ Formyl cation 1ΣC∞v
324 HCS Thioformyl radical 2A'Cs
325 HCS+ Thioformyl cation 1ΣC∞v
326 HNO Nitrosyl hydride 1A'Cs
327 HNO- Nitrosyl hydride anion 2A"Cs
328 HNO+ Nitrosyl hydride cation 2A'Cs
329 NOH Hydroxyimidogen 3A"Cs
330 NOH+ O-protonated nitric oxide 2A'Cs
331 HNS- Sulfur imide anion 2ACs
332 HO2 Hydroperoxy radical 2A"Cs
333 HO2- Hydroperoxy anion 1A'Cs
334 HO2+ Hydroperoxy cation 3A"Cs
335 HO2+ Hydroperoxy cation 1A'Cs
336 SOH Sulfur Hydroxide   
337 SOH+ Sulfur Monoxide, protonated   
338 HS2 Thiosulfeno radical 2A"Cs
339 H2CO- formaldehyde anion 2A'Cs
340 H2CO- formaldehyde anion   
341 H2CO+ formaldehyde cation 2B2C2v
342 H2CS- thioformaldehyde anion   
343 H2CS- thioformaldehyde anion   
344 H2CS+ thioformaldehyde cation 2B2C2v
345 H2NO nitroxide 2B1C2v
346 H2NO nitroxide 2A'Cs
347 H2O2+ Hydrogen peroxide cation 2BgC2h
348 H2O2+ Hydrogen peroxide cation 2A1C2v
349 H2S2+ hydrogen disulfide cation 2BgC2h
350 CH2OH Hydroxymethyl radical 2AC1
351 CH3O Methoxy radical 2A'C1
352 CH3O+ Methoxy cation 3A1C3v
353 CH3S thiomethoxy 2A'C3v
354 NH2OH+ Hydroxylamine cation   
355 CH3OH- Methyl alcohol anion 2A'Cs
356 CH3OH- Methyl alcohol anion 2A'CS eclipsed
357 CH3OH+ Methyl alcohol cation 2A"Cs
358 CH3OH+ Methyl alcohol cation 2AC1
359 CH3SH+ Methanethiol cation 2A"Cs
360 NH2OH2+ protonated hydroxylamine   
361 NH3OH+ N-protonated hydroxylamine   
362 NaF+ sodium fluoride cation 2ΣC∞v
363 LiF- lithium fluoride anion 2ΣC∞v
364 LiF+ lithium fluoride cation 2ΠC∞v
365 BeF Beryllium monofluoride 2ΣC∞v
366 BeF- Beryllium monofluoride anion 1ΣC∞v
367 BeF+ Beryllium monofluoride cation 1ΣC∞v
368 BeCl beryllium monochloride 2ΣC∞v
369 TiCl Titanium Monochloride 4ΣC∞v
370 ZnF Zinc monofluoride 2ΣC∞v
371 CaBr Calcium monobromide   
372 GaF Gallium monofluoride 1ΣC∞v
373 GaF+ Gallium monofluoride cation 2ΣC∞v
374 GaCl Gallium monochloride 1ΣGC∞v
375 GaCl+ Gallium monochloride cation 2ΣC∞v
376 CF Fluoromethylidyne 2ΠC∞v
377 CF- carbon monofluoride anion 3ΣC∞v
378 CCl carbon monochloride 2ΠC∞v
379 SiF silicon monofluoride 2ΠC∞v
380 SiF- silicon monofluoride anion 3ΣC∞v
381 SiCl Clorosilylidyne 2ΠC∞v
382 CBr Carbon monobromide 2ΠC∞v
383 GeF Germanium monofluoride 2ΠC∞v
384 GeCl Germanium monochloride 2ΠC∞v
385 SiBr Silicon monobromide 2ΠC∞v
386 SiBr+ Silicon monobromide cation   
387 NF nitrogen fluoride 3ΣC∞v
388 NCl nitrogen monochloride 3ΣC∞v
389 NCl- nitrogen monochloride anion 2ΠC∞v
390 NCl+ nitrogen monochloride cation 2ΠC∞v
391 PF phosphorus monofluoride 3ΣC∞v
392 AsF Arsenic monofluoride 3ΣC∞v
393 NBr nitrogen monobromide 3Σ-C∞v
394 AsCl Arsenic monochloride 3ΣC∞v
395 PBr Phosphorus monobromide   
396 FO Oxygen monofluoride 2ΠC∞v
397 ClO Monochlorine monoxide 2ΠC∞v
398 ClO+ chlorine monoxide cation 3ΣC∞v
399 SF Monosulfur monofluoride 2ΠC∞v
400 SF+ sulfur monofluoride cation 3ΣC∞v
401 SCl sulfur monochloride 2ΠC∞v
402 SCl+ sulfur monochloride cation 3ΣgC∞v
403 BrO Bromine monoxide 2ΠC∞v
404 BrO+ Bromine monoxide cation   
405 SeF Selenium monofluoride 2ΠC∞v
406 SBr Sulfur monobromide radical   
407 SBr+ Sulfur monobromide cation   
408 SeCl Selenium monochloride 2ΠC∞v
409 SeBr Selenium monobromide   
410 F2- flourine diatomic anion 2ΣuD∞h
411 F2+ flourine diatomic cation 2ΠgD∞h
412 ClF Chlorine monofluoride 1Σ+C∞v
413 ClF+ clorine monofluoride cation 2ΠC∞v
414 Cl2- chlorine diatomic anion 2ΣuD∞h
415 Cl2+ chlorine diatomic cation 2ΠgD∞h
416 Br2- bromine diatomic anion 2ΣuD∞h
417 Br2+ bromine diatomic cation 2ΠgD∞h
418 HCF Fluoromethylene 3A"Cs
419 HCCl Chloromethylene 3A"Cs
420 CHBr bromomethylene 3A"Cs
421 HOCl+ hypochlorous acid cation   
422 HOBr+ Hypobromous acid cation 2A"Cs
423 FHF- Hydrogen difluoride anion 1ΣgD∞h
424 CH2Br bromomethyl radical 2A'Cs
425 CH2Br bromomethyl radical   
426 CH2F fluoromethyl radical 2ACs
427 CH2Cl chloromethyl radical 2A'Cs
428 CH2Cl chloromethyl radical 2B1C2v
429 CH3F+ methyl fluoride cation   
430 CH3Cl+ Methyl chloride cation   
431 CH3Br methyl bromide 1A1C3v
432 Ne2+ Neon diatomic cation 2ΣuD∞h
433 Ar2+ Argon diatomic cation 2ΣuD∞h
434 Li3 Lithium trimer 2B2C2v
435 C3 carbon trimer 1A1C2v
436 C3+ carbon trimer cation 2ΣuD∞h
437 C3H3 cyclopropenyl radical 2A'Cs
438 C3H3 Propargyl radical 2B1Cs
439 C3H3- Propargyl anion 1A'Cs
440 C3H3+ Propargyl cation 1A1C2v
441 C3H5 Allyl radical 2A2C2v
442 C3H5 Allyl radical 2A"Cs
443 CH3CHCH 1-propenyl radical 2A'Cs
444 C3H7 n-Propyl radical 2A"C1
445 CH3CHCH3 Isopropyl radical 2AC2
446 LiCN lithium cyanide 1ΣC*V LiCN
447 ZnCN Zinc monocyanide 2ΣC∞v
448 ZnNC Zinc isocyanide 2ΣC∞v
449 CNN Diazocarbene   
450 NCN Cyanoimidogen 3ΣgD∞h
451 N3 azide radical 2ΠgD∞h
452 N3+ azide cation 3ΣgD∞h
453 N3+ azide cation 3ΣC∞v
454 HCCN cyanomethylene 3A"Cs
455 HCCN cyanomethylene 3ΣC∞v
456 HCCN cyanomethylene   
457 HN3 hydrogen azide 1A'Cs
458 HN3+ Hydrazoic acid cation   
459 CH3CN- acetonitrile anion 2EC3v
460 CH3CN- acetonitrile anion 2A'Cs
461 CH3CN+ Acetonitrile cation 2A"Cs
462 HCNCH2+ 2H-Azirine cation   
463 CH2CHNH vinylazine 2A"CS cis
464 CH2CHNH vinylazine 2A"CS trans
465 CH3CHN methylmethaniminyl radical 2A'Cs
466 Li2O+ dilithium oxide cation 2ΠD∞h
467 LiO2 Lithium dioxide   
468 NaO2 Sodium superoxide   
469 CCO Dicarbon monoxide 3ΣC∞v
470 NCO isocyanato radical 2ΠC∞v
471 SCN thiocyanato radical 2ΠC∞v
472 BO2 Boron dioxide 2A'D∞h
473 BO2+ Boron dioxide cation 3ΣgD∞h
474 N2O- Nitrous oxide anion 2A'Cs
475 N2O+ Nitrous oxide cation 2ΠC∞v
476 CO2- Carbon dioxide anion 2A1C2v
477 CO2+ Carbon dioxide cation 2ΠgD∞h
478 CO2+ Carbon dioxide cation 2ΠC∞v
479 OCS+ Carbonyl sulfide cation 2ΠC∞v
480 CS2- Carbon disulfide anion 2A1C2v
481 CS2+ Carbon disulfide cation 2ΠD∞h
482 NO2 Nitrogen dioxide 2A1C2v
483 NO2- Nitrogen dioxide anion 1A1C2v
484 NO2+ Nitrogen dioxide cation 1ΣGD∞h
485 NSO sulfinyl amidogen   
486 PO2 Phosphorus dioxide 2A1C2v
487 PO2+ Phosphorus dioxide cation 1ΣGD∞h
488 SNO Nitrogen oxide sulfide   
489 AsO2 Aresenic dioxide 2A1C2v
490 O3- Ozone anion 2B1C2v
491 O3+ Ozone cation 2A1C2v
492 SO2 Sulfur dioxide 1A1C2v
493 SO2- Sulfur dioxide anion 2B1C2v
494 SO2+ Sulfur dioxide cation 2A1C2v
495 S3- Sulfur trimer anion 2B1C2v
496 S3+ Sulfur trimer cation 2B2C2v
497 SeO2+ Selenium dioxide cation 2A1C2v
498 HCCO ketenyl radical 2ΠC∞v
499 HCCO ketenyl radical 2A"Cs
500 HCOO formate neutral radical 2A'Cs
501 HOCO Hydrocarboxyl radical 1A'cis
502 HOCO Hydrocarboxyl radical 1A'trans
503 HOCO+ Hydrocarboxyl cation 1A'Cs
504 HNO2+ nitrous acid cation 2A'Cs
505 CH2CO+ Ketene cation 2B1C2v
506 CH2CHO Vinyloxy radical 2A"Cs
507 CH3CO Acetyl radical 2A'Cs
508 CH2OOH CH2OOH radical 2AC1
509 CH3OO methylperoxy radical 2A"Cs
510 CH3OO+ methylperoxy cation 1A'Cs
511 C2H4O+ ethylene oxide cation   
512 CH3CHO+ acetaldehyde cation   
513 H2COCH2+ Methyl, (methyleneoxoniumyl)-   
514 CH2CH2OH 2-hydroxy ethyl radical 2A'Cs
515 CH2CH2OH 2-hydroxy ethyl radical 2AC1
516 CH3CH2O Ethoxy radical 2A'Cs
517 CH3CHOH 1-hydroxy-ethyl radical 2AC1
518 CH3OCH2 methoxymethyl radical 2AC1
519 CH3CH2SH ethanethiol 1A'Cs
520 CH3SCH3+ dimethyl sulfide cation   
521 CuF2 Copper difluoride 2ΠgD∞h
522 FCO Carbonyl fluoride 2A'Cs
523 ClCO carbonyl monochloride 2A'Cs
524 BF2 Boron difluoride radical 2A1C2v
525 BrNO Nitrosyl bromide 1A'Cs
526 CF2 Difluoromethylene 3B1C2v
527 CF2- Difluoromethylene anion 2B1C2v
528 CF2+ Difluoromethylene cation 2A1C2v
529 SiF2 Silicon difluoride 1A1C2v
530 SiF2 Silicon difluoride 3B1C2v
531 SiF2+ Silicon difluoride cation 2A1C2v
532 CCl2- dichloromethylene anion 2B1C2v
533 CCl2+ dichloromethylene cation 2A1C2v
534 CBr2 dibromomethylene 3B1C2v
535 FOO Dioxygen monofluoride radical 2A"Cs
536 FOO+ Fluorine dioxide cation   
537 ClOO chloroperoxy radical 2A"Cs
538 ClOO+ chloroperoxy cation 1A'Cs
539 OClO Chlorine dioxide 2B1D∞h
540 OClO- Chlorine dioxide anion 1A'Cs
541 OClO+ Chlorine dioxide cation 1A1C2v
542 ClSO Sulfur chloride oxide 2A"Cs
543 ClS2 Sulfur chloride 2A"Cs
544 BrOO Bromine dioxide   
545 OBrO Bromine dioxide radical 2B1C2v
546 NF2 Difluoroamino radical 2B1C2v
547 NF2+ Difluoroamino cation 1A1C2v
548 PF2 Phosphorus difluoride   
549 SF2- sulfur difluoride anion 2A'Cs
550 SF2- sulfur difluoride anion 2ΠD∞h
551 SF2+ sulfur difluoride cation 2B1C2v
552 BrOCl Bromine hypochlorite 1A'Cs
553 BrOBr Bromine oxide 1A1C2v
554 HCCF+ fluoroacetylene cation 2ΠC∞v
555 HFCO+ formyl fluoride cation 2A'Cs
556 COHCl Formyl chloride 1A'Cs
557 COHBr Formyl bromide 1A'Cs
558 CHCl2 dichloromethyl radical 2B1C2v
559 CHCl2 dichloromethyl radical 2A'Cs
560 CHF2 difluoromethyl radical 2ACs
561 CHFCl Chlorofluoromethyl radical   
562 CHBr2 dibromomethyl radical   
563 CH2CHF Ethene, fluoro- 1A'Cs
564 CH3OCl methyl hypochlorite 1A'Cs
565 CH2CH2Cl 2-chloroethyl radical 2A'Cs
566 CHClCH3 1-chloroethyl radical 2AC1
567 C4 Carbon tetramer 3ΣgD∞h
568 C4H2+ diacetlyene cation 2ΠgD∞h
569 CH3CHCHCH2 methylallyl radical 2A"Cs
570 C(CH3)3 Tert-butyl radical 2A"C3v
571 CH2CH(CH3)2 Isobutyl radical 2A'C1
572 CH3CHCH2CH3 2-Butyl radical 1AC1
573 C2N2+ Cyanogen cation 2ΠgD∞h
574 HCCCN+ Cyanoacetylene cation 2ΠC∞v
575 C3H3N+ acrylonitrile cation 2A"Cs
576 NO3+ nitrogen trioxide cation 1A1C2v
577 NO3+ nitrogen trioxide cation 1A1'D3h
578 SO3- Sulfur trioxide anion 2A1pyramidal
579 SO3- Sulfur trioxide anion 2A2"planar
580 SO3+ Sulfur trioxide cation 2A2'D3h
581 HSO3 Hydroxysulfonyl radical 2AC1
582 C2H2O2 Ethanedial 1AgC2h
583 CH3COCH2 Acetonyl radical 2A"Cs
584 C2H5OO ethylperoxy radical 2A'Cs
585 CH3COCH3- acetone anion 2A'Cs
586 C2Cl2+ dichloroacetylene cation 2ΠUD∞h
587 BrONO Bromine nitrite 1A'CS trans
588 CF2O+ Carbonic difluoride cation   
589 COFCl Carbonic chloride fluoride 1A'Cs
590 COBr2 Carbonic dibromide 1A1C2v
591 BF3- Borane, trifluoro- anion 2A1D3h
592 BF3- Borane, trifluoro- anion 2A1C3v
593 BF3+ boron trifluoride cation 2A2'D3h
594 BF3+ boron trifluoride cation 2B2C2v
595 BF3+ boron trifluoride cation   
596 BCl3+ Boron Trichloride cation   
597 CF3 Trifluoromethyl radical 2A1C3v
598 CF3- Trifluoromethyl anion 1A1C3v
599 CF3+ Trifluoromethyl cation 1A1'D3h
600 CF2Cl difluorochloromethyl radical   
601 SiF3 Silicon trifluoride radical 2A1C3v
602 SiF3+ Silicon trifluoride cation 1A1'D3h
603 CFCl2 dichlorofluoromethyl radical   
604 CCl3 Trichloromethyl radical 2A1C3
605 CCl3- Trichloromethyl anion 1A1C3v
606 CCl3+ Trichloromethyl cation 1A1'D3h
607 CBr3 tribromomethyl radical   
608 NF3 Nitrogen trifluoride 1A1C3v
609 NF3- Nitrogen trifluoride anion 2A1C3v
610 NF3- Nitrogen trifluoride anion 2ACs
611 NF3+ Nitrogen trifluoride cation 2A1C3v
612 SF3 Sulfur trifluoride 2A'Cs
613 CHBrF2 Methane, bromodifluoro- 1A'Cs
614 CHBrCl2 Methane, bromodichloro- 1A'Cs
615 CHClBr2 Methane, dibromochloro- 1A'Cs
616 CH2ClCHO chloroacetaldehyde 1AC1 bisecting, trans
617 CH2BrCH2Br Ethane, 1,2-dibromo- 1AgC2h
618 CH3CH2CH2Br n-propyl bromide 1A'Cs
619 CH3CHBrCH3 i-propyl bromide 1A'Cs
620 C5H5 cyclopentadienyl radical 2B1C2v
621 C5H7 cyclopentenyl radical 2A2C2v
622 C5H11 2-Methylbut-2-yl radical 1AC1
623 C3H3N2 imidazolyl radical 2B1C2v
624 C4H4N pyrrolide radical 2A2C2v
625 C3O2+ Carbon suboxide cation 2ΠUD∞h
626 CBrClF2 Methane, bromochlorodifluoro- 1A'Cs
627 CBr4 Carbon tetrabromide 1A1Td
628 C2HF3+ Trifluoroethylene cation 2A"Cs
629 CHCl2CHO dichloroacetaldehyde 1AC1
630 CH3CF2Cl 1-Chloro-1,1-Difluoroethane 1A'Cs
631 C6H5 phenyl 2A1C2v
632 SF5 Sulfur pentafluoride 2A1C4v
633 CF3CHO trifluoroacetaldehyde 1A'Cs
634 CCl3CHO trichloroacetaldehyde 1A'Cs
635 CF3CH2Cl 2,2,2-Trifluoroethyl chloride 1A'Cs
636 C6H5CH2 benzyl radical 2B1Cs
637 C7H7 cycloheptatrienyl radical 2A2C2v
638 C6H13N cyclohexanamine 1AC1
639 C6H5O phenoxy radical 2B1C2v
640 PF6 Hexafluorophosphate neutral 2B2C2v
641 C6H12O2 Methyl pivalate 1AC1
642 C6H12O2 Hexanoic acid 1A1Cs
643 CF3CF2Cl pentafluorochloroethane 1A'Cs
644 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 K Potassium atom k  
12 K- Potassium atom anion k-  
13 K+ Potassium atom cation k+  
14 Cu Copper atom cu  
15 Cu- Copper atom anion cu-  
16 Cu+ Copper atom cation cu+  
17 LiH Lithium Hydride lih  
18 LiH- lithium hydride anion lih-  
19 NaH sodium hydride nah  
20 NaH- sodium hydride anion nah-  
21 KH Potassium hydride kh  
22 KH+ Potassium hydrogen cation kh+  
23 CuH Copper monohydride cuh  
24 Be Beryllium atom be  
25 Be- Beryllium atom anion be-  
26 Mg Magnesium atom mg  
27 Ca Calcium atom ca  
28 Ca- Calcium atom anion ca-  
29 Ca+ Calcium atom cation ca+  
30 Zn Zinc atom zn  
31 Zn- Zinc atom anion zn-  
32 Zn+ Zinc atom cation zn+  
33 BeH- berylium monohydride anion beh-  
34 BeH+ beryllium monohydride cation beh+  
35 MgH- magnesium monohydride anion mgh-  
36 MgH+ magnesium monohydride cation mgh+  
37 CaH+ Calcium monohydride cation cah+  
38 ZnH Zinc monohydride znh  
39 ZnH+ Zinc, protonated znh+  
40 BeH2 beryllium dihydride beh2  
41 MgH2 magnesium dihydride mgh2  
42 CaH2 Calcium Hydride cah2  
43 ZnH2 Zinc hydride znh2  
44 B- Boron atom anion b-  
45 BH Boron monohydride bh  
46 BH- boron monohydride anion bh-  
47 BH+ boron monohydride cation bh+  
48 AlH aluminum monohydride alh  
49 AlH- aluminum monohydride anion alh-  
50 AlH+ aluminum monohydride cation alh+  
51 ScH Scandium monohydride sch  
52 GaH Gallium monohydride gah  
53 BH2+ Boron dihydride cation bh2+  
54 BH3 boron trihydride bh3  
55 BH3- boron trihydride anion bh3-  
56 AlH3 aluminum trihydride alh3  
57 ScH3 Scandium trihydride sch3  
58 GaH3 Gallium trihydride gah3  
59 AlH4- Aluminum tetrahydride anion alh4-  
60 C- Carbon atom anion c-  
61 Ti Titanium atom ti  
62 Ti- Titanium atom anion ti-  
63 Ti+ Titanium atom cation ti+  
64 Sn Tin atom sn  
65 Sn+ Tin cation sn+  
66 CH- methylidyne anion ch-  
67 CH+ Methylidyne cation ch+  
68 SiH+ silicon monohydride cation sih+  
69 GeH+ Germaniun monohyrdide cation geh+  
70 CD4 methane-d4 cd4  
71 CH2D2 methane-d2 ch2d2  
72 CH3D methane-d ch3d  
73 CH4 Methane ch4  
74 CH4- Methane anion ch4-  
75 CH4+ Methane cation ch4+  
76 CHD3 methane-d3 chd3  
77 SiH2D2 silane-d2 sih2d2  
78 SiH4 Silane sih4  
79 GeH4 Germane geh4  
80 SnH4 Stannane snh4  
81 SiH5+ Silane, protonated sih5+  
82 Sb Antimony atom sb  
83 NH- Imidogen anion nh-  
84 NH+ imidogen cation nh+  
85 PH- phosphorus monohydride anion ph-  
86 PH+ phosphorus monohydride cation ph+  
87 SbH Antimony monohydride sbh  
88 NH2- amino anion nh2-  
89 AsH2+ Arsenic dihydride cation ash2+  
90 ND3 Ammonia-d3 nd3  
91 NH3 Ammonia nh3  
92 PH3 Phosphine ph3  
93 AsH3 Arsine ash3  
94 SbH3 Stibine sbh3  
95 AsH4+ Arsonium ash4+  
96 NH4+ ammonium cation nh4+  
97 PH4+ phosphonium cation ph4+  
98 Cr Chromium atom cr  
99 Te Tellurium atom te  
100 Te+ Tellurium atom cation te+  
101 OH- hydroxide anion oh-  
102 HSe- selenium monohydride anion hse-  
103 TeH Telluryl radical teh  
104 D2O Deuterium oxide d2o  
105 H2O Water h2o  
106 HDO Water-d1 hdo  
107 D2S Hydrogen sulfide-d2 d2s  
108 H2S Hydrogen sulfide h2s  
109 H2Te Hydrogen Telluride h2te  
110 H3O+ hydronium cation h3o+  
111 H3Se+ Hydrogen Selenide, protonated h3se+  
112 Mn Manganese atom mn  
113 I Iodine atom iodine  
114 I- Iodine atom anion iodine-  
115 I+ Iodine atom cation iodine+  
116 DF Hydrofluoric acid-d df  
117 HF Hydrogen fluoride hf  
118 DCl Hydrochloric acid-d dcl  
119 HCl Hydrogen chloride hcl  
120 HI Hydrogen iodide hi  
121 HI+ Hydrogen iodide cation hi+  
122 H2F+ dihydrogen fluoride cation h2f+  
123 H2Br+ protonated hydrogen bromide h2br+  
124 H2I+ Iodonium h2i+  
125 Ne Neon atom ne  
126 Ar Argon atom ar  
127 Fe Iron atom fe  
128 Kr Krypton atom kr  
129 Xe Xenon atom xe  
130 HeLi+ Helium Lithium cation heli+  
131 NeH+ neon hydrogen cation neh+  
132 KrH+ Protonated Krypton krh+  
133 XeH+ Xenon, protonated xeh+  
134 H2Ar H2 Ar dimer h2ar  
135 Co Cobalt atom cobalt  
136 Ni Nickel atom ni  
137 Li2 Lithium diatomic li2  
138 Li2- lithium diatomic anion li2-  
139 NaLi lithium sodium lina  
140 NaLi- lithium sodium anion lina-  
141 NaLi+ lithium sodium cation lina+  
142 LiK Lithium Potassium lik  
143 Na2 Sodium diatomic na2  
144 NaK Sodium Potassium nak  
145 NaK+ Sodium Potassium diatomic cation nak+  
146 K2 Potassium diatomic k2  
147 Cu2 Copper diatomic cu2  
148 Be2 Beryllium diatomic be2  
149 Be2+ Beryllium diatomic cation be2+  
150 BeMg Beryllium Magnesium bemg  
151 Mg2 Magnesium diatomic mg2  
152 Mg2- magnesium diatomic anion mg2-  
153 Mg2+ magnesium diatomic cation mg2+  
154 Ca2 Calcium diatomic ca2  
155 LiAl Lithium Aluminum lial  
156 NaAl Sodium aluminum naal  
157 B2- Boron diatomic anion b2-  
158 Al2 Aluminum diatomic al2  
159 Al2- aluminum diatomic anion al2-  
160 Al2+ aluminum diatomic cation al2+  
161 LiBH4 Lithium borohydride libh4  
162 B2H4 Diborane(4) D2d b2h4  
163 HBHHBH Diborane(4) C2V hbhhbh  
164 B2H6 Diborane b2h6  
165 Al2H6 dialane al2h6  
166 Ga2H6 digallane ga2h6  
167 BC+ boron monocarbide cation bc+  
168 C2 Carbon diatomic c2  
169 C2- carbon diatomic anion c2-  
170 Si2- silcon diatomic anion si2-  
171 Si2+ silcon diatomic cation si2+  
172 C2H- Ethynyl anion c2h-  
173 C2H+ Ethynyl cation c2h+  
174 ZnCH2 Zinc methylene znch2  
175 C2H2 Acetylene c2h2  
176 Si2H2 disilyne si2h2  
177 CuCH3 monomethyl copper cuch3  
178 ZnCH3 Zinc monomethyl znch3  
179 CH2BH methyleneborane ch2bh  
180 C2H3- vinyl anion c2h3-  
181 C2H4 Ethylene c2h4  
182 CH2SiH2 silaethylene ch2sih2  
183 Si2H4 Disilene si2h4  
184 CH3BH2 methylborane ch3bh2  
185 C2H5- Ethyl anion c2h5-  
186 C2H5+ Ethyl cation c2h5+  
187 C2H6 Ethane c2h6  
188 CH3SiH3 methyl silane ch3sih3  
189 Si2H6 disilane si2h6  
190 GeH3CH3 methyl germane geh3ch3  
191 C2H7+ Ethane, protonated c2h7+  
192 BeN+ Beryllium mononitride cation ben+  
193 BN- boron nitride anion bn-  
194 AlN- aluminum mononitride anion aln-  
195 AlN+ aluminum mononitride cation aln+  
196 BN+ boron nitride cation bn+  
197 CN- cyanide anion cn-  
198 CN+ Cyano cation cn+  
199 CP- carbon monophosphide anion cp-  
200 CP+ carbon monophosphide cation cp+  
201 SiN- silicon mononitride anion sin-  
202 SiN+ silicon mononitride cation sin+  
203 TiN Titanium mononitride tin  
204 N2 Nitrogen diatomic n2  
205 PN Phosphorus mononitride pn  
206 PN- phosphorus nitride anion pn-  
207 PN+ phosphorus nitride cation pn+  
208 P2 Phosphorus diatomic p2  
209 P2- phosphorus diatomic anion p2-  
210 P2+ phosphorus diatomic cation p2+  
211 AsN Arsenic mononitride asn  
212 AsP Arsenic monophosphide asp  
213 SbN Antimony nitride sbn  
214 As2 Arsenic diatomic as2  
215 HNC hydrogen isocyanide hnc  
216 HCN Hydrogen cyanide hcn  
217 HCN- Hydrogen cyanide anion hcn-  
218 HCP Phosphaethyne hcp  
219 NNH+ Dinitrogen monohydride cation nnh+  
220 HPO Hydrogen phosphorus oxide hpo  
221 LiNH2 lithium amide linh2  
222 HBNH Boranimine hbnh  
223 CNH2+ N-protonated hydrogen isocyanide cnh2+  
224 HCNH+ N-protonated HCN hcnh+  
225 H2NN Isodiazene h2nn  
226 N2H2 (E)-diazene n2h2  
227 N2H2 (Z)-Diazene n2h2z  
228 CH2NH Methanimine ch3n  
229 CHNH2 aminomethylene chnh2  
230 CH2PH Phosphaethene ch3p  
231 BH2NH2 Boranamine bh2nh2  
232 CH2NH2+ methyleneamine cation ch2nh2+  
233 N2H4 Hydrazine n2h4  
234 P2H4 Diphosphine p2h4  
235 CH3NH2 methyl amine ch3nh2  
236 CH3PH2 Methyl phosphine ch3ph2  
237 SiH3NH2 Silane, amino sih3nh2  
238 N2H5+ protonated hydrazine n2h5+  
239 BH3PH3 borane phosphine bh3ph3  
240 BH3NH3 borane ammonia bh3nh3  
241 CH3NH3+ protonated methylamine ch3nh3+  
242 CH3PH3+ methyl phosphine, protonated ch3ph3+  
243 NH3NH3 Ammonia Dimer nh3nh3  
244 N2H7+ ammonia ammonium dimer n2h7+  
245 NaO- sodium oxide anion nao-  
246 NaO+ sodium oxide cation nao+  
247 KO Potassium monoxide ko  
248 KO+ Potassium monoxide cation ko+  
249 CuO Copper Monoxide cuo  
250 BeO beryllium oxide beo  
251 BeS beryllium sulfide bes  
252 MgO magnesium oxide mgo  
253 MgO- magnesium oxide anion mgo-  
254 MgO+ magnesium oxide cation mgo+  
255 CaO Calcium monoxide cao  
256 MgS magnesium sulfide mgs  
257 MgS- magnesium sulfide anion mgs-  
258 MgS+ magnesium sulfide cation mgs+  
259 CaS Calcium sulfide cas  
260 ZnO zinc monoxide zno  
261 ZnS Zinc sulfide zns  
262 BeS- Beryllium monosulfide anion bes-  
263 BeS+ Beryllium monosulfide cation bes+  
264 AlO- Aluminum monoxide anion alo-  
265 AlO+ aluminum monoxide cation alo+  
266 BS- boron monosulfide anion bs-  
267 BS+ boron monosulfide cation bs+  
268 AlS- aluminum monosulfide anion als-  
269 AlS+ aluminum monosulfide cation als+  
270 BO+ boron monoxide cation bo+  
271 CO Carbon monoxide co  
272 CS carbon monosulfide cs  
273 CS- carbon monosulfide anion cs-  
274 CS+ carbon monosulfide cation cs+  
275 SiO Silicon monoxide sio  
276 SiO- silicon monoxide anion sio-  
277 SiO+ silicon monoxide cation sio+  
278 SiS silicon monosulfide sis  
279 SiS- silicon monosulfide anion sis-  
280 SiS+ silicon monosulfide cation sis+  
281 CSe Carbon monoselenide cse  
282 CSe- Carbon monoselenide anion cse-  
283 CSe+ Carbon monoselenide cation cse+  
284 GeO Germanium monoxide geo  
285 GeS Germanium monosulfide ges  
286 SiSe Silicon Monoselenide sise  
287 GeSe Germanium monoselenide gese  
288 NO+ nitric oxide cation no+  
289 NS+ nitrogen sulfide cation ns+  
290 PO- phosphorus monoxide anion po-  
291 PO+ phosphorus monoxide cation po+  
292 PS- phosphorus monosulfide anion ps-  
293 PS+ phosphorus monosulfide cation ps+  
294 O2-- dioxygen dianion o2--  
295 SO- sulfur monoxide anion so-  
296 S2- sulfur diatomic anion s2-  
297 S2+ sulfur diatomic cation s2+  
298 SeO- selenium monoxide anion seo-  
299 SeO+ selenium monoxide cation seo+  
300 SeS Selenium monosulfide ses  
301 SeS- selenium monosulfide anion ses-  
302 SeS+ selenium monosulfide cation ses+  
303 TeO Tellurium monoxide teo  
304 Se2- selenium diatomic anion se2-  
305 Se2+ selenium diatomic cation se2+  
306 Te2 Tellurium diatomic te2  
307 LiOH lithium hydroxide lioh  
308 NaOH sodium hydroxide naoh  
309 KOH Potassium hydroxide koh  
310 MgOH magnesium hydroxide mgoh  
311 CaOH Calcium monohydroxide caoh  
312 HBO Boron hydride oxide hbo  
313 HBS hydrogen boron sulfide hbs  
314 COH+ Carbon Monoxide, protonated coh+  
315 HCS- Thioformyl anion hcs-  
316 HNS Sulfur imide hns  
317 HSO+ Sulfur Monoxide, S-protonated HSO+  
318 H2CO Formaldehyde h2co  
319 HOCH hydroxycarbene hoch  
320 H2CS Thioformaldehyde h2cs  
321 H2CSe Selenoformaldehyde h2cse  
322 H2O2 Hydrogen peroxide h2o2  
323 H2OO water oxide h2oo  
324 HOSH hydrogen thioperoxide hosh  
325 H2S2 Disulfane h2s2  
326 H2Se2 hydrogen diselenide h2se2  
327 CH2OH+ hydroxymethyl cation ch2oh+  
328 CH3O- methoxy anion ch3o-  
329 H2CSH+ Thioformaldehyde, protonated h2csh+  
330 NH2OH hydroxylamine nh2oh  
331 NH3O Ammonia Oxide nh3o  
332 H2POH Phosphinous acid h2poh  
333 H3PO Phosphine oxide h3po  
334 NH2SH Thiohydroxylamine nh2sh  
335 NH3S sulfidoazane nh3s  
336 H3O2+ hydrogen peroxide, protonated h3o2+  
337 CH3OH Methyl alcohol ch3oh  
338 CH3SH Methanethiol ch3sh  
339 SiH3OH silanol sih3oh  
340 CH3SeH Methane selenol ch3seh  
341 H2OH2O water dimer h2oh2o  
342 CH3OH2+ Methanol, protonated ch3oh2+  
343 CH3SH2+ protonated methylsulfide ch3sh2+  
344 H2ONH3 Water Ammonia Dimer h2onh3  
345 H5O2+ Dihydroxonium ion h5o2+  
346 LiF lithium fluoride lif  
347 LiCl lithium chloride licl  
348 LiCl- lithium chloride anion licl-  
349 LiCl+ lithium chloride cation licl+  
350 NaF sodium fluoride naf  
351 NaF- sodium fluoride anion naf-  
352 KF Potassium Fluoride kf  
353 NaCl Sodium Chloride nacl  
354 NaCl- sodium chloride anion nacl-  
355 NaCl+ sodium chloride cation nacl+  
356 KCl Potassium Chloride kcl  
357 CuF Copper monofluoride cuf  
358 LiBr Lithium Bromide libr  
359 LiBr- lithium bromide anion libr-  
360 LiBr+ lithium bromide cation libr+  
361 CuCl Copper monochloride cucl  
362 NaBr Sodium Bromide nabr  
363 NaBr- sodium bromide anion nabr-  
364 NaBr+ sodium bromide cation nabr+  
365 KBr Potassium Bromide kbr  
366 LiI Lithium Iodide lii  
367 NaI Sodium Iodide nai  
368 KI Potassium Iodide ki  
369 MgF- magnesium fluoride anion mgf-  
370 MgF+ magnesium fluoride cation mgf+  
371 CaF Calcium monofluoride caf  
372 MgCl- magnesium monochloride anion mgcl-  
373 MgCl+ magnesium monochloride cation mgcl+  
374 CaCl calcium monochloride cacl  
375 ZnF- Zinc monofluoride anion znf-  
376 ZnF+ Zinc monofluoride cation znf+  
377 ZnCl Zinc monochloride zncl  
378 BeCl- beryllium monochloride anion becl-  
379 BeCl+ beryllium monochloride cation becl+  
380 BF Boron monofluoride bf  
381 BF- Boron monofluoride anion bf-  
382 BF+ Boron monofluoride cation bf+  
383 AlF Aluminum monofluoride alf  
384 AlF- Aluminum monofluoride anion alf-  
385 AlF+ Aluminum monofluoride cation alf+  
386 BCl boron monochloride bcl  
387 BCl- boron monochloride anion bcl-  
388 BCl+ boron monochloride cation bcl+  
389 AlCl Aluminum monochloride alcl  
390 AlCl- aluminum monochloride anion alcl-  
391 AlCl+ aluminum monochloride cation alcl+  
392 ScF Scandium monofluoride scf  
393 BBr Boron monobromide bbr  
394 AlBr Aluminum monobromide albr  
395 AlI Aluminum monoiodide ali  
396 GaBr Gallium monobromide gabr  
397 CF+ carbon monofluoride cation cf+  
398 CCl- carbon monochloride anion ccl-  
399 CCl+ carbon monochloride cation ccl+  
400 SiF+ silicon monofluoride cation sif+  
401 SiCl- silicon monochloride anion sicl-  
402 SiCl+ silicon monochloride cation sicl+  
403 GeF+ Germanium monofluoride cation gef+  
404 GeCl+ Germanium monochloride cation gecl+  
405 NF- nitrogen monofluorine anion nf-  
406 NF+ nitrogen monofluoirde cation nf+  
407 PF- phosphorus monofluoride anion pf-  
408 PF+ phosphorus monofluoride cation pf+  
409 PCl phosphorus chloride pcl  
410 PCl- phosphorus monochloride anion pcl-  
411 PCl+ phosphorus monochloride cation pcl+  
412 SbF Antimony monofluoride sbf  
413 SbCl Antimony monochloride sbcl  
414 FO- flourine oxide anion fo-  
415 FO+ fluorine monoxide cation fo+  
416 ClO- chlorine monoxide anion clo-  
417 SF- sulfur monofluoride anion sf-  
418 SCl- sulfur monochloride anion scl-  
419 BrO- Bromine monoxide anion bro-  
420 IO Iodine monoxide io  
421 BrCl Bromine monochloride brcl  
422 F2 Fluorine diatomic f2  
423 ClF- clorine monofluoride anion clf-  
424 Cl2 Chlorine diatomic cl2  
425 BrF Bromine monofluoride brf  
426 BrF- bromine fluoride anion brf-  
427 BrF+ bromine fluoride cation brf+  
428 BrCl- bromine chloride anion brcl-  
429 BrCl+ bromine chloride cation brcl+  
430 IF Iodine monofluoride if  
431 Br2 Bromine diatomic br2  
432 ICl Iodine monochloride icl  
433 IBr Iodine monobromide ibr  
434 I2 Iodine diatomic i2  
435 I2+ Iodine diatomic cation i2+  
436 HCF Fluoromethylene hcf  
437 HCCl Chloromethylene hccl  
438 HSiF fluorosilylene hsif  
439 HSiCl Chlorosilylene hsicl  
440 HSiBr monobromosilylene hsibr  
441 CHBr bromomethylene chbr  
442 HOF Hypofluorous acid hfo  
443 DOCl Hypochlorous acid-d docl  
444 HOCl hypochlorous acid hocl  
445 HOBr Hypobromous acid hobr  
446 HOI Hypoiodous acid hoi  
447 F2H+ Fluorine, protonated f2h+  
448 FHF Hydrogen difluoride fhf  
449 ClFH+ Chlorine fluoride, F-protonated clfh+  
450 FClH+ Chlorine fluoride, Cl-protonated fclh+  
451 Cl2H+ Chlorine, protonated cl2h+  
452 CH2F+ fluoromethyl cation ch2f+  
453 CH2Cl+ chloromethyl cation ch2cl+  
454 NH2F monofluoroamine nh2f  
455 NH2Cl chloramine nh2cl  
456 H2F2 Hydrogen fluoride dimer h2f2  
457 CD3F methylfluoride-d3 cd3f  
458 CH3F Methyl fluoride ch3f  
459 CD3Cl methyl chloride d3 cd3cl  
460 CH3Cl Methyl chloride ch3cl  
461 SiH3F monofluorosilane sih3f  
462 SiH3Cl chlorosilane sih3cl  
463 GeH3F monofluorogermane geh3f  
464 GeH3Cl monochlorogermane geh3cl  
465 SiH3Br bromosilane sih3br  
466 CH3I methyl iodide ch3i  
467 SiH3I Silyl Iodide sih3i  
468 NH3Cl+ protonated monochloroammonia nh3cl+  
469 CH3ClH+ methyl chloride, protonated ch3clh+  
470 NH4Cl Ammonium chloride nh4cl  
471 LiNe+ Lithium Neon cation line+  
472 Ne2 Neon diatomic ne2  
473 Ar2 Argon diatomic ar2  
474 Li3+ Lithium trimer cation li3+  
475 SiC2 Silicon dicarbide sic2  
476 C3H3+ cyclopropenyl cation cpr+  
477 C3H4 cyclopropene cprop  
478 CH2CCH2 allene allene  
479 CH3CCH propyne propyne  
480 C3H5+ Allyl cation allyl+  
481 Zn(CH3)2 dimethyl zinc dmz  
482 C3H6 Cyclopropane c3h6  
483 CH2CHCH3 Propene propene  
484 C3H7+ cyclopropane, protonated c3h7+  
485 CH3CHCH3+ Isopropyl cation prop2yl+  
486 C3H8 Propane propane  
487 SiH2(CH3)2 dimethylsilane dms  
488 Si3H8 trisilane si3h8  
489 NaCN Sodium Cyanide nacn  
490 KCN Potassium cyanide kcn  
491 CuCN Copper cyanide cucn  
492 AlCN Aluminum monocyanide alcn  
493 AlNC Aluminum isocyanide alnc  
494 CN2 3H-Diazirin-3-ylidene cn2  
495 N3- azide anion n3-  
496 HCNN diazomethyl radical hcnn  
497 HNCNH diiminomethane hncnh  
498 CH2N2 diazirine ch2n2  
499 CH2NN diazomethane ch2nn  
500 NH2CN cyanamide cyanamide  
501 HNNNH+ 1,2-Triazadienium n2h3+  
502 NH2NN+ hydrazoic acid, protonated nh2nn+  
503 CH3CN Acetonitrile ch3cn  
504 CH3NC methyl isocyanide ch3nc  
505 CHNCH2 2H-Azirine c157164  
506 CHNHCH 1H-Azirine chnhch  
507 H2CCNH Ethenimine ch2cnh  
508 H2CNCH methyleneaminomethylene ch2nch  
509 HCCNH2 Ethynamine hccnh2  
510 HNCNH2+ diiminomethane, protonated hncnh2+  
511 NCNH3+ Cyanamide, protonated ncnh3+  
512 NH2CNH+ cyanamide, cn protonated nh2cnh+  
513 NH3CN+ cyanamide, amine protonated nh3cn+  
514 NHCHNH2 aminomethanimine cn2h4  
515 C2H5N Aziridine c2h5n  
516 CH2CHNH2 aminoethene aminoethene  
517 CH2NCH3 N-methylmethanimine nmm  
518 CH3CHNH ethanimine ethanimine  
519 NH2BHNH2 diaminoborane nh2bhnh2  
520 C2H5NH+ Protonated Aziridine c2h5nh+  
521 C2H6N+ aziridine, protonated c2h6n+  
522 NH2CH2NH2 diaminomethane nh2ch2nh2  
523 CH3CH2NH2 Ethylamine etam  
524 CH3NHCH3 Dimethylamine ch3nhch3  
525 CH3PHCH3 dimethylphosphine ch3phch3  
526 NH2CH2NH3+ diaminoethane, protonated pdam  
527 (CH3)2NH2+ dimethylammonium cation dmam  
528 CH3CH2NH3+ ethylamine, protonated pea  
529 Li2O dilithium oxide li2o  
530 Li2S dilithium sulfide li2s  
531 Na2O disodium monoxide na2o  
532 Na2S Sodium sulfide na2s  
533 CNO- fulminate cno-  
534 NCO- cyanate nco-  
535 SCN- thiocyanide anion scn-  
536 BO2- Boron dioxide anion bo2-  
537 NNS Nitrogen sulfide nns  
538 PPO Phosphorus oxide phosphide ppo  
539 CO2 Carbon dioxide co2  
540 OCS Carbonyl sulfide cos  
541 SiO2 silicon dioxide sio2  
542 CS2 Carbon disulfide cs2  
543 TiO2 Titanium dioxide tio2  
544 SiS2 Silicon disulfide sis2  
545 GeO2 Germanium dioxide geo2  
546 OCSe Carbonyl selenide ocse  
547 SCSe Carbon sulfide selenide scse  
548 GeS2 Germanium disulfide ges2  
549 CSe2 Carbon diselenide cse2  
550 SCTe Carbon sulfide Telluride scte  
551 PO2- Phosphorus dioxide anion po2-  
552 O3 Ozone o3  
553 SSO Disulfur monoxide sso  
554 S3 Sulfur trimer s3  
555 SeO2 Selenium dioxide seo2  
556 TeO2 Tellurium Dioxide teo2  
557 CS2H+ Carbon disulfide, protonated cs2h+  
558 HCNO fulminic acid hcno  
559 HNCO Isocyanic acid hnco  
560 HOCN cyanic acid hocn  
561 HNCS Isothiocyanic acid hncs  
562 HSCN thiocyanic acid hscn  
563 HCO2- formate anion hco2-  
564 HNNO nitrosoazane hnno  
565 HNNO+ Nitrous oxide, N-protonated hnno+  
566 NNOH+ Nitrous Oxide, O-protonated nnoh+  
567 HNO2 Nitrous acid hno2  
568 O3H+ protonated ozone o3h+  
569 SO2H+ protonated sulfur dioxide so2h+  
570 C2H2O Oxirene oxirene  
571 CH2CO Ketene ch2co  
572 HCCOH ethynol hccoh  
573 CH2CS Thioketene ch2cs  
574 Be(OH)2 Beryllium hydroxide beo2h2  
575 Mg(OH)2 Magnesium dihydroxide h2mgo2  
576 NH2NO Nitrosamide nh2no  
577 CH2O2 Dioxirane diox  
578 H2COO Dioxymethyl radical h2coo  
579 H2COO+ dioxymethyl cation h2coo+  
580 HCOOH Formic acid ch2o2  
581 H2O3 Hydrogen trioxide h2o3  
582 HSSSH trisulfane hsssh  
583 NaOCH3 Sodium methoxide naoch3  
584 CH2BOH hydroxy(methylene)borane ch2boh  
585 BH3CO Borane carbonyl bh3co  
586 CH3BO Borane, methyloxo- ch3bo  
587 CH2COH+ ketene, protonated ch2coh+  
588 CH3CO- Acetyl anion ch3co-  
589 CH3CO+ acetyl cation ch3co+  
590 CH2NOH formaldoxime ch2noh  
591 CH3NO nitrosomethane ch3no  
592 CHONH2 formamide formamide  
593 CNOH3 1,2-oxaziridine cnoh3  
594 HOCHNH hydroxymethylimine hochnh  
595 CHSNH2 thioformamide chsnh2  
596 NHCHSH Methanimidothioic acid nhchsh  
597 CH3OO- methylperoxy anion ch3oo-  
598 C2H4O Ethylene oxide c2h4o  
599 CH2CHOH ethenol ch2choh  
600 CH3CHO Acetaldehyde ch3cho  
601 C2H4S Thiirane thiirane  
602 CH2CHSH Ethenethiol ch2chsh  
603 CH3CHS Thioacetaldehyde ch3chs  
604 H2CONH2+ protonated formamide h2conh2+  
605 NH2CHOH+ Formamide, O-protonated nh2choh+  
606 NH3CHO+ Formamide, N-Protonated nh3cho+  
607 CH2(OH)2 methanediol ch2o2h2  
608 CH3OOH Methyl peroxide ch3ooh  
609 CH3SSH Hydrogen methyl disulfide ch3ssh  
610 HSCH2SH Methanedithiol ch4s2  
611 H2OH2CO water formaldehyde dimer h2oh2co  
612 C2H4OH+ ethylene oxide, protonated c2h4oh+  
613 CH3CHOH+ acetaldehyde, protonated ch3choh+  
614 NH2CH2OH aminomethanol nh2ch2oh  
615 CH3CH2OH Ethanol etoh  
616 CH3OCH3 Dimethyl ether meome  
617 CH3SCH3 Dimethyl sulfide mesme  
618 CH3SeCH3 dimethylselenide dmse  
619 CH3OHH2O methanol water dimer ch3ohh2o  
620 H2OCH3OH water methanol dimer h2och3oh  
621 ZnF2 Zinc difluoride znf2  
622 CNF iso cyanogen fluoride cnf  
623 FCN Cyanogen fluoride fcn  
624 ClCN chlorocyanogen clcn  
625 BrCN Cyanogen bromide brcn  
626 ICN Cyanogen iodide icn  
627 FBO Boron monofluoride monoxide fbo  
628 BeF2 Beryllium fluoride bef2  
629 MgF2 Magnesium fluoride mgf2  
630 BeCl2 Beryllium chloride becl2  
631 MgCl2 Magnesium dichloride mgcl2  
632 CaCl2 Calcium Chloride cacl2  
633 ZnCl2 Zinc dichloride zncl2  
634 BeBr2 Beryllium bromide bebr2  
635 CaBr2 Calcium dibromide cabr2  
636 CaF2 Calcium difluoride caf2  
637 FCO+ Carbonyl fluoride cation fco+  
638 FNO Nitrosyl fluoride fno  
639 ClNO Nitrosyl chloride clno  
640 FNS Thionitrosyl fluoride fns  
641 FSN Thiazyl fluoride fsn  
642 OPCl Phosphorus oxychloride opcl  
643 INO Nitrosyl iodide ino  
644 CF2 Difluoromethylene cf2  
645 CFCl chlorofluoromethylene cfcl  
646 CCl2 dichloromethylene ccl2  
647 SiCl2 Dichlorosilylene sicl2  
648 GeF2 Germanium difluoride gef2  
649 GeCl2 Germanium dichloride gecl2  
650 CBr2 dibromomethylene cbr2  
651 PF2+ Phosphorus difluoride cation pf2+  
652 FClO chlorosyl fluoride fclo  
653 F2O Difluorine monoxide f2o  
654 ClOF Chlorine hypofluorite clof  
655 SF2 sulfur difluoride sf2  
656 Cl2O Dichlorine monoxide cl2o  
657 SCl2 Sulfur dichloride scl2  
658 SeF2 Selenium difluoride sef2  
659 SeCl2 Selenium Dichloride secl2  
660 SBr2 Sulfur dibromide sbr2  
661 SeBr2 Selenium dibromide sebr2  
662 F3- trifluoride anion f3-  
663 Cl3- trichloride anion cl3-  
664 Br3- tribromide anion br3-  
665 I3- triiodide i3-  
666 SFCl Sulfur chloride fluoride sfcl  
667 HCCF Fluoroacetylene hccf  
668 HCCCl Chloroacetylene hcccl  
669 HCCBr bromoacetylene hccbr  
670 HFCO formyl fluoride hfco  
671 BHF2 Difluoroborane bhf2  
672 BHCl2 Borane, dichloro- bhcl2  
673 CHF2+ difluoromethyl cation chf2+  
674 CHFCl+ Chlorofluoromethyl cation chfcl+  
675 CHCl2+ dichloromethyl cation chcl2+  
676 HOClO Chlorous acid hoclo  
677 NHF2 difluoramine nhf2  
678 NHCl2 dichloroamine nhcl2  
679 CH2F2 Methane, difluoro- ch2f2  
680 CH2FCl fluorochloromethane ch2fcl  
681 SiH2F2 difluorosilane sih2f2  
682 CH2Cl2 Methylene chloride ch2cl2  
683 CH2BrF Methane, bromofluoro- ch2fbr  
684 CH2BrCl Methane, bromochloro- ch2clbr  
685 CH2FI fluoroiodomethane ch2fi  
686 CH2Br2 dibromomethane ch2br2  
687 CH2ClI chloroiodomethane ch2cli  
688 CH2BrI bromoiodomethane ch2bri  
689 CH2I2 Diiodomethane ch2i2  
690 SiH2Cl2 dichlorosilane sih2cl2  
691 CH3MgBr Methyl Magnesium Bromide ch3mgbr  
692 CH2CHF+ fluoroethene cation ch2chf+  
693 C2H3Cl Ethene, chloro- ch2chcl  
694 C2H3Br vinyl bromide c2h3br  
695 C2H3I Vinyl iodide c2h3i  
696 CH2FOH fluoromethanol ch2foh  
697 C2H5F fluoroethane c2h5f  
698 CH3CH2Cl Ethyl chloride c2h5cl  
699 CH3SiFH2 fluoromethylsilane ch3sifh2  
700 C2H5Br Ethyl bromide etbr  
701 C2H5I Ethyl iodide c2h5i  
702 KrF2 Krypton difluoride krf2  
703 XeF2 Xenon difluoride xef2  
704 B4H10 Tetraborane(10) b4h10  
705 C4+ Carbon tetramer cation c4+  
706 C4H2 Diacetylene c4h2  
707 C2H3CCH 1-Buten-3-yne c2h3cch  
708 C4H4 cyclobutadiene cbd  
709 C4H4 Tetrahedrane c4h4  
710 H2CCCCH2 Butatriene h2cccch2  
711 C4H6 1-Methylcyclopropene c3100047  
712 C4H6 Cyclobutene c822355  
713 C4H6 Methylenecyclopropane c6142730  
714 CH2CCHCH3 1,2-Butadiene butad12  
715 CH2CHCHCH2 1,3-Butadiene c106990  
716 CH3CCCH3 2-Butyne c503173  
717 CHCCH2CH3 1-Butyne c107006  
718 C4H8 methylcyclopropane mcp  
719 CH2C(CH3)CH3 1-Propene, 2-methyl- isobute  
720 CH2CHCH2CH3 1-Butene bute1  
721 CH3CHCHCH3 2-Butene, (E)- bute2e  
722 CH3CHCHCH3 2-Butene, (Z)- bute2z  
723 B(CH3)3 trimethylborane bme3  
724 Al(CH3)3 trimethyl aluminum tma  
725 CH3CH(CH3)CH3 Isobutane isobutane  
726 CH3CH2CH2CH3 Butane butane  
727 SiH(CH3)3 trimethylsilane trimsi  
728 Li3N trilithium nitride li3n  
729 C2N2 Cyanogen c2n2  
730 P4 Phosphorus tetramer p4  
731 As4 Arsenic tetramer as4  
732 HCCCN Cyanoacetylene hcccn  
733 H2CNCN cyanamide, methylene ch2ncn  
734 HNCCNH Ethenediimine hnccnh  
735 C3H3N acrylonitrile ch2chcn  
736 CH3N3 methyl azide ch3n3  
737 NH2CCNH2 Diaminoacetylene daa  
738 NH2CH2CN Aminoacetonitrile aan  
739 CH3NHN2+ methyl azide, protonated ch3nhn2+  
740 C2H5CN ethyl cyanide c2h5cn  
741 CH5N3 Guanidine guanidine  
742 C4H6 Bicyclo[1.1.0]butane c157335  
743 CH3NNCH3 (Z)-1,2-Dimethyldiazene dmdiazz  
744 H2NCHCHNH2 diaminoethylene dae  
745 CH6N3+ guanidinium ch6n3+  
746 C3H7N Cyclopropylamine cpram  
747 CH7N3 triaminomethane tam  
748 C3H7N Azetidine azet  
749 C4H8 cyclobutane cbutane  
750 C2H8N2 Ethylenediamine ethdiam  
751 CH3NHNHCH3 dimethyl hydrazine dmh  
752 CH3CH(NH2)CH3 2-Propanamine pram2  
753 N(CH3)3 Trimethylamine trimeam  
754 NH2CH2CH2CH3 1-Propanamine pram1  
755 P(CH3)3 trimethylphosphine tmp  
756 N(SiH3)3 trisilylamine tsa  
757 As(CH3)3 trimethyl arsine tmas  
758 (CH3)3NH+ protonated trimethyl amine ptma  
759 C3H7NH3+ n-propylamine, protonated c3h7nh2  
760 Li2O2 dilithium dioxide li2o2  
761 Na2O2 disodium dioxide na2o2  
762 K2O2 dipotassium dioxide k2o2  
763 C3O Tricarbon monoxide c3o  
764 B2O2 Diboron dioxide b2o2  
765 ONNO NO dimer onno  
766 S2N2 Disulfur dinitride s2n2  
767 CO3 Carbon trioxide co3  
768 CO3-- carbonate co3--  
769 CS3-- Carbonotrithioate cs3--  
770 NO3- nitrate anion no3-  
771 SO3 Sulfur trioxide so3  
772 SO3-- Sulfate dianion so3--  
773 SeO3 selenium trioxide seo3  
774 S4 Sulfur tetramer s4  
775 TeO3 Tellurium trioxide teo3  
776 HCO3- bicarbonate anion hco3-  
777 HNO3 Nitric acid hno3  
778 NH2NO2 nitramide nh2no2  
779 C2H2CO cyclopropenone c2h2co  
780 C3H2O Propadienal c3h2o  
781 HCCCHO 2-propynal hcccho  
782 C2H2O2+ Ethanedial cation c2h2o2+  
783 H2CO3 Carbonic acid h2co3  
784 H2CS3 thiocarbonic acid h2cs3  
785 H2NO3+ Nitric Acid, Protonated h2no3+  
786 H2SO3 Sulfurous acid h2so3  
787 C2H3NO Nitrosoethylene c2h3no  
788 CH3NCO methylisocyante ch3nco  
789 HOCH2CN cyanomethanol hoch2cn  
790 CH3COO- acetate anion ch3coo-  
791 CH3NO2 Methane, nitro- ch3no2  
792 CH3ONO Methyl nitrite ch3ono  
793 NH2COOH Carbamic acid nh2cooh  
794 H3BO3 Boric acid h3bo3  
795 H3AlO3 Aluminum hydroxide h3alo3  
796 H3CO3+ carbonic acid, protonated h3co3+  
797 C3H4O 2-Propyn-1-ol c107197  
798 C3H4O allenol c9000071  
799 C3H4O Cyclopropanone cpone  
800 C3H4O Methylketene c6004440  
801 CH2CHCHO Acrolein c3h4o  
802 NH2CONH2 Urea urea  
803 NH2CONH2+ Urea cation urea+  
804 NH2CSNH2 Thiourea thiourea  
805 C2H4O2 1,3-dioxetane c2h4o2  
806 CH3COOH Acetic acid ch3cooh  
807 CH3OCHO methyl formate ch3ocho  
808 CHOCH2OH hydroxy acetaldehyde haa  
809 NH2COOH2+ Carbamic acid, O-protonated nh2cooh2+  
810 NH3COOH+ protonated Carbamic acid nh3cooh+  
811 H2OHCOOH Water formic acid dimer 1 h2ohcooh_10  
812 H2OHCOOH Water formic acid dimer 2 h2ohcooh_11  
813 HCOOHH2O Formic acid water dimer hcoohh2o  
814 HOCH2OOH hydroxy methyl peroxide hoch2ooh  
815 CH2C(OH)NH2 1-amino vinyl alchohol ava  
816 CH3C(OH)=NH Ethaninidic acid eia  
817 CH3CHNOH Acetaldoxime acetaldoxime  
818 CH3CONH2 Acetamide acetamide  
819 HCONHCH3 N-methylformamide nmfa  
820 CH3CSNH2 Ethanethioamide ch3csnh2  
821 CH5N2O+ urea, N-protonated ch4n2o+  
822 H2NCOHNH2+ urea, protonated ureah+  
823 CH3NNCH3 (E)-1,2-Dimethyldiazene dmdiaze  
824 C3H5OH Cyclopropanol cproh  
825 C3H6O 2-Propen-1-ol c107186  
826 C3H6O Acetone enol enol  
827 C3H6O Oxetane oxetane  
828 C3H6O Propylene oxide prox  
829 CH3CH2CHO Propanal propanal  
830 CH3COCH3 Acetone acetone  
831 C3H6S Thietane thietane  
832 C3H6S Thiirane, methyl- methiirane  
833 CH3CSCH3 Thioacetone ch3csch3  
834 C2H6O2 1,2-Ethanediol ethdiol  
835 CH3OOCH3 dimethylperoxide dmp  
836 CH3SOCH3 Dimethyl sulfoxide dmso  
837 CH2SHCH2SH 1,2-Ethanedithiol ethdisl  
838 CH3SSCH3 Disulfide, dimethyl ch3ssch3  
839 CH3COHCH3+ acetone, protonated acetoneh+  
840 HOCH2CH2NH2 monoethanolamine mea  
841 C3H7OH 1-Propanol proh  
842 CH3CHOHCH3 Isopropyl alcohol isoproh  
843 CH3OC2H5 Ethane, methoxy- etome  
844 C3H7SH 1-Propanethiol prsh  
845 CH3CHSHCH3 2-Propanethiol isoprsh  
846 CH3SCH2CH3 Ethane, (methylthio)- etsme  
847 H2OCH3OCH3 water dimethylether dimer h2och3och3  
848 Li2F2 Lithium fluoride dimer li2f2  
849 Na2F2 Sodium Fluoride Dimer na2f2  
850 Na2Cl2 Disodium dichloride na2cl2  
851 C2F2 difluoroacetylene c2f2  
852 C2Cl2 dichloroacetylene c2cl2  
853 FNO2 Nitryl fluoride fno2  
854 FONO Nitrosyl hypofluorite fono  
855 ClNO2 Nitryl chloride clno2  
856 ClONO chlorine nitrite clono  
857 N2F2 (Z)-Difluorodiazene n2f2_z  
858 N2F2 Dinitrogen difluoride, (E)- n2f2_e  
859 CF2O Carbonic difluoride f2co  
860 CCl2O Phosgene cl2co  
861 Cl2CS Thiophosgene cl2cs  
862 BF3 Borane, trifluoro- bf3  
863 AlF3 Aluminum trifluoride alf3  
864 BClF2 Chlorodifluoroborane bclf2  
865 AlF2Cl Aluminum chloride difluoride alclf2  
866 ScF3 Scandium trifluoride ScF3  
867 AlFCl2 Aluminum dichloride fluoride alcl2f  
868 BCl3 Borane, trichloro- bcl3  
869 GaF3 Gallium trifluoride gaf3  
870 AlCl3 Aluminum trichloride alcl3  
871 GaCl3 Gallium trichloride gacl3  
872 BBr3 Boron tribromide bbr3  
873 AlBr3 Aluminum Bromide albr3  
874 ClO3 Chlorine trioxide clo3  
875 ClO3- chlorate anion clo3-  
876 BrO3- Bromate anion bro3-  
877 SiCl3 trichlorosilyl radical sicl3  
878 SiCl3+ trichlorosilyl cation sicl3+  
879 FOOF Perfluoroperoxide foof  
880 ClO2F Chloryl fluoride clo2f  
881 F2SO Thionyl Fluoride f2so  
882 ClOOCl Dichlorine dioxide cloocl  
883 FSSF Difluorodisulfane fssf  
884 S2F2 Thio-thionyl fluoride s2f2  
885 SOCl2 thionyl chloride socl2  
886 SSCl2 Thiothionyl chloride sscl2  
887 SeOCl2 selenium oxychloride seocl2  
888 PF3 Phosphorus trifluoride pf3  
889 NCl3 nitrogen trichloride ncl3  
890 AsF3 Arsenic trifluoride asf3  
891 PCl3 Phosphorus trichloride pcl3  
892 SbF3 Antimony Trifluoride sbf3  
893 AsCl3 Arsenous trichloride ascl3  
894 SbCl3 Antimony Trichloride sbcl3  
895 NBr3 Nitrogen Tribromide nbr3  
896 PBr3 Phosphorus tribromide pbr3  
897 AsBr3 Arsenic tribromide asbr3  
898 NI3 Nitrogen triiodide ni3  
899 PI3 Phosphorus triiodide pi3  
900 ClSSCl Disulfur dichloride s2cl2  
901 ClF3 Chlorine trifluoride clf3  
902 BrF3 Bromine trifluoride brf3  
903 IF3 iodone trifluoride if3  
904 HClO3 Chloric Acid hclo3  
905 CHF3 Methane, trifluoro- chf3  
906 CHF2Cl difluorochloromethane chf2cl  
907 SiHF3 trifluorosilane sihf3  
908 CHFCl2 fluorodichloromethane chfcl2  
909 CDCl3 trichloromethane-d cdcl3  
910 CHCl3 Chloroform chcl3  
911 SiHCl3 Trichlorosilane sihcl3  
912 CHFClBr fluorochlorobromomethane chfclbr  
913 CHF2I difluoroiodomethane chf2i  
914 CHBr2F dibromofluoromethane chbr2f  
915 CHFClI fluorochloroiodomethane chfcli  
916 CHCl2I dichloroiodomethane chcl2i  
917 CHBr3 bromoform chbr3  
918 CHI3 Iodoform chi3  
919 NF3H+ protonated nitrogen trifluoride nf3h+  
920 AsF3H+ Arsenic trifluoride, protonated asf3h+  
921 C2H2F2 Ethene, 1,2-difluoro-, (E)- c2h2f2e  
922 C2H2F2 Ethene, 1,2-difluoro-, (Z)- c2h2f2z  
923 CH2CF2 Ethene, 1,1-difluoro- ch2cf2  
924 C2H2ClF 1-chloro-1-fluoroethylene c2h2clf  
925 CHFCHCl (E)-1-chloro-2-fluoroethene chfchcle  
926 CHFCHClz (Z)-1-Chloro-2-fluoroethene chfchclz  
927 CH2CCl2 Ethene, 1,1-dichloro- ch2ccl2  
928 CHClCHCl Ethene, 1,2-dichloro-, (E)- chclchcle  
929 CHClCHCl Ethene, 1,2-dichloro-, (Z)- chclchclz  
930 C2H2Br2 1,1-dibromoethene c2h2br2  
931 CHBrCHBr Ethene, 1,2-dibromo-, (E)- chbrchbre  
932 CHBrCHBr Ethene, 1,2-dibromo-, (Z)- chbrchbrz  
933 CH2FCHO Fluoroacetaldehyde ch2fcho  
934 CH3COF Acetyl fluoride ch3cof  
935 CH3COCl Acetyl Chloride ch3cocl  
936 C2H4F2 1,2-difluoroethane c2h4f2  
937 CH3CHF2 Ethane, 1,1-difluoro- ch3chf2  
938 CH2FCH2Cl Ethane, 1-chloro-2-fluoro- ch2fch2cl  
939 CH3CHFCl Ethane, 1-chloro-1-fluoro- ch3chfcl  
940 CH2ClCH2Cl Ethane, 1,2-dichloro- ch2clch2cl  
941 CH3CHCl2 Ethane, 1,1-dichloro- ch3chcl2  
942 CH2BrCH2Cl 1-bromo-2-chloroethane ch2brch2cl  
943 CH2CFCH3 2-fluoropropene 2fpro  
944 CH2CHCH2F Allyl Fluoride allylf  
945 CH3CHCHF trans-1-Fluoro-1-propene propene1ft  
946 C3H5Cl 1-Propene, 3-chloro- prop1cl3  
947 C3H5Cl 1-chloro-1-propene(E) prop1cl1e  
948 C3H5Cl 1-chloro-1-propene(Z) prop1cl1z  
949 CH2FCH2OH 2-fluoroethanol ch2fch2oh  
950 CH2ClCH2OH 2-Chloroethanol ch2clch2oh  
951 CH2ClCH2OH2+ 2-chloroethanol, protonated ch2clch2oh2+  
952 CH2FCH2CH3 1-Fluoropropane prf1  
953 CH3CHFCH3 2-Fluoropropane prf2  
954 CH2ClCH2CH3 Propane, 1-chloro- prcl1  
955 CH3CHClCH3 Propane, 2-chloro- prcl2  
956 C3H9O+ trimethyl oxonium cation c3h9o+  
957 B5H9 pentaborane9 b5h9  
958 C5H4 pentatetraene ptrene  
959 C5H5- cylopentadienyl anion c5h5-  
960 C5H6 1,3-Cyclopentadiene c542927  
961 C5H6 1-Buten-3-yne, 2-methyl- c78808  
962 C5H6 3-Penten-1-yne, (E)- c2004695  
963 C5H6 3-Penten-1-yne, (Z)- c1574409  
964 C5H6 Bicyclo[2.1.0]pent-2-ene c5164352  
965 C5H6 Cyclopropylacetylene c6746947  
966 C5H6 Propellane propellane  
967 C5H7 1,3-pentadienyl radical pdyl  
968 C5H8 1,2-Butadiene, 3-methyl- c598254  
969 C5H8 1,2-Pentadiene c591957  
970 C5H8 1,3-Butadiene, 2-methyl- c78795  
971 C5H8 1,3-Pentadiene, (E)- c2004708  
972 C5H8 1,3-Pentadiene, (Z)- c1574410  
973 C5H8 1,4-Pentadiene c591935  
974 C5H8 1-pentyne a1pentyne  
975 C5H8 2,3-Pentadiene c591968  
976 C5H8 Bicyclo[1.1.1]pentane bcp  
977 C5H8 Cyclobutane, methylene- c1120565  
978 C5H8 Cyclopentene c142290  
979 C5H8 Ethenylcyclopropane c693867  
980 CH3CCCH2CH3 2-Pentyne 2pentyne  
981 C5H10 1-Butene, 2-methyl- c563462  
982 C5H10 2-Butene, 2-methyl- c513359  
983 C5H10 2-Pentene, (E)- c646048  
984 C5H10 2-Pentene, (Z)- c627203  
985 C5H10 Cyclopentane c287923  
986 C5H10 Cyclopropane, 1,1-dimethyl- c1630940  
987 CH2CHCH2CH2CH3 1-pentene pentene  
988 C5H12 Butane, 2-methyl- buta2  
989 C5H12 Pentane pentane  
990 C5H12 Propane, 2,2-dimethyl- neopentane  
991 Si(CH3)4 tetramethylsilane tms  
992 N2O3 Dinitrogen trioxide n2o3  
993 C3H2N2 Malononitrile c3h2n2  
994 CH2N4 1H-Tetrazole 1htz  
995 C3H3N2- imidizolyl anion im-  
996 C2H3N3 1H-1,2,4-Triazole c288880  
997 C4H4N- pyrrolide anion c4h4n-  
998 C3H4N2 1H-Imidazole 1himidaz  
999 C3H4N2 1H-Pyrazole 1hpyraz  
1000 C3H4N2 2H-Imidazole imid2h  
1001 C3H4N2 4H-Imidazole imid4h  
1002 C4H5N (E)-2-Butenenitrile c627269  
1003 C4H5N (Z)-2-Butenenitrile c1190767  
1004 C4H5N 2H-pyrrole pyrrole2  
1005 C4H5N 3H-pyrrole pyrrole3  
1006 C4H5N Cyclopropanecarbonitrile c5500210  
1007 C4H5N Pyrrole pyrrole  
1008 CH2CHCH2CN Allylcyanide ch2chch2cn  
1009 C4H6N+ pyrrole, alpha-protonated appyr  
1010 C4H6N+ pyrrole, beta-protonated bppyr  
1011 C4H6N+ pyrrole, protonated ppyr  
1012 C3H6N2 3-Aminopropionitrile c151188  
1013 CH3CH(CH3)CN Propanenitrile, 2-methyl- c4h7n  
1014 CH3CH2CH2CN Butanenitrile c109740  
1015 C5H8 Bicyclo[2.1.0]pentane c185944  
1016 C5H8 Spiropentane c157404  
1017 C4H9N Cyclobutylamine cbam  
1018 C4H9N Pyrrolidine pyrrolidine  
1019 C3H10N2 1,2-Diaminopropane diampr12  
1020 C(CH3)3NH2 2-Propanamine, 2-methyl- c75649  
1021 C(NH2)H2C(CH3)HCH3 1-Propanamine, 2-methyl- c78819  
1022 C(NH2)H2CH2CH2CH3 1-Butanamine butam1  
1023 CH3C(NH2)HCH2CH3 2-Butanamine butam2  
1024 NH(C2H5)2 diethylamine dea  
1025 NC4H12+ tetramethyl ammonium cation nc4h12+  
1026 C3O2 Carbon suboxide c3o2  
1027 B2O3 diboron trioxide b2o3  
1028 MgCO3 Magnesium Carbonate mgco3  
1029 BeCO3 Beryllium Carbonate beco3  
1030 CaCO3 Calcium Carbonate caco3  
1031 ONONO Nitrosyl nitrite onono  
1032 PO4--- phosphate po4---  
1033 SO4-- sulfate so4--  
1034 HOONO2 peroxy nitric acid hoono2  
1035 HSO4- bisulfate anion hso4-  
1036 C2H2N2S 1,3,4-Thiadiazole c2h2n2s  
1037 C3H2O2 Propiolic acid c3h2o2  
1038 CHOCOOH oxo acetic acid oaa  
1039 CHOOCHO diformyl ether choocho  
1040 H2SO4 Sulfuric acid h2so4  
1041 H2SeO4 Selenic acid h2seo4  
1042 C3H3NO Isoxazole isox  
1043 C3H3NO Oxazole oxazole  
1044 C3H3NS Thiazole thiazole  
1045 CH3C(O)OO acetyl peroxy radical ch3coo2  
1046 CH3NO3 Methyl nitrate ch3no3  
1047 H3PO4 Phosphoric Acid h3po4  
1048 C4H4O Furan furan  
1049 C4H4O+ Furan cation furan+  
1050 CH3COCCH 3-butyn-2-one c1423605  
1051 C4H4S Thiophene furans  
1052 C4H4Se selenophene c4h4se  
1053 C3H4O2 β–Propiolactone beta  
1054 C3H4O2 2-Propenoic acid propenoic2  
1055 C3H4O2 Methyl glyoxal megly  
1056 C3H4O2 propanedial propanedial  
1057 C3H4O2 propenalol propenalol  
1058 HOCHCCHOH allenediol aldiol  
1059 C2H4O3 1,2,3-trioxolane c2h4o3  
1060 C2H4O3 trioxolane124 triox  
1061 HOCH2COOH Hydroxyacetic acid hac  
1062 CH2CHCONH2 Acrylamide c79061  
1063 CH3OCH2CN Methoxyacetonitrile c1738369  
1064 CH5N3S Hydrazinecarbothioamide c79196  
1065 H2NCH2COOH Glycine glycine  
1066 CH3SO2NH2 methanesulfonamide ch3so2nh2  
1067 C4H6O cis-2-butenal butenal2c  
1068 C4H6O Cyclobutanone cbutone  
1069 C4H6O Furan, 2,3-dihydro- furan23h  
1070 C4H6O Furan, 2,5-dihydro- furan25h  
1071 CH2CHOCHCH2 Vinyl ether vinylether  
1072 CHOCHCHCH3 2-Butenal butenal2  
1073 C4H6S Thiophene, 2,3-dihydro- thiop23h  
1074 C4H6S Thiophene, 2,5-dihydro- thiop25h  
1075 CH2CHSCHCH2 Divinyl sulfide divis  
1076 C2H6N2O Urea, methyl- c598505  
1077 C3H6O2 1,3-Dioxolane dioxolane  
1078 CH3CH2COOH Propanoic Acid propanoic  
1079 CH3COOCH3 methyl acetate aame  
1080 HCOOC2H5 Ethyl formate faee  
1081 C2H6O2S Dimethyl sulfone c67710  
1082 CH3SSSCH3 dimethyl trisulfide c2h6s3  
1083 C3H7NO dimethylformamide dmf  
1084 C3H7NO Propanamide propanam  
1085 C2H3OC2H5 Ethene, ethoxy- c109922  
1086 C4H8O Cyclobutanol c2919235  
1087 C4H8O Furan, tetrahydro- thf  
1088 CH2C(CH3)OCH3 1-Propene, 2-methoxy- pre1meo2  
1089 CH3COCH2CH3 2-Butanone buta2one  
1090 CHOCH(CH3)CH3 Propanal, 2-methyl- c78842  
1091 CHOCH2CH2CH3 Butanal butanal  
1092 C4H8S Thiophene, tetrahydro- tht  
1093 C3H8O2 1,3-Propanediol c504632  
1094 C3H8O2 Hydroperoxide, 1-methylethyl c3031752  
1095 C3H8O2 Methane, dimethoxy- c109875  
1096 C3H8O2 Propylene glycol c57556  
1097 C3H8S2 1,3-Propanedithiol c109808  
1098 C4H10O 1-Butanol butanol1  
1099 C4H10O 1-Propanol, 2-methyl- c78831  
1100 C4H10O 2-Butanol, (.+/-.)- butanol2  
1101 C4H10O Ethanol, 1,1-dimethyl- tbuoh  
1102 C4H10O Ethoxy ethane etoet  
1103 C4H10O Methyl propyl ether meopr  
1104 C4H10O Propane, 2-methoxy- c598538  
1105 C4H10O+ 1-Butanol cation butanol1+  
1106 C(CH3)3SH 2-Propanethiol, 2-methyl- tbush  
1107 C2H5SC2H5 Diethyl sulfide etset  
1108 C4H9SH 1-Butanethiol bush  
1109 CH2(SH)CH(CH3)CH3 1-Propanethiol, 2-methyl- c513440  
1110 CH3C(SCH3)HCH3 Propane, 2-(methylthio)- mesipr  
1111 CH3CH(SH)CH2CH3 2-Butanethiol butansl2  
1112 FNO3 Fluorine nitrate fno3  
1113 ClONO2 Chlorine nitrate clono2  
1114 BrONO2 Bromine nitrate brono2  
1115 TiCl4 Titanium tetrachloride ticl4  
1116 ClO4- perchlorate anion clo4-  
1117 BF4- tetrafluoroboron anion bf4-  
1118 ClFO3 Perchloryl fluoride clfo3  
1119 SO2F2 Sulfuryl fluoride so2f2  
1120 SO2Cl2 Sulfuryl chloride so2cl2  
1121 F3NO Nitrogen trifluoride oxide f3no  
1122 F3PO Phosphoryl fluoride pf3o  
1123 Cl3PO Phosphoryl chloride pcl3o  
1124 CF4 Carbon tetrafluoride cf4  
1125 CF3Cl Methane, chlorotrifluoro- cf3cl  
1126 SiF4 Silicon tetrafluoride sif4  
1127 CF2Cl2 difluorodichloromethane cf2cl2  
1128 TiF4 Titanium tetrafluoride tif4  
1129 CFCl3 Trichloromonofluoromethane cfcl3  
1130 CF3Br Bromotrifluoromethane cf3br  
1131 GeF4 Germanium tetrafluoride gef4  
1132 CCl4 Carbon tetrachloride ccl4  
1133 CCl4+ Carbon tetrachloride cation ccl4+  
1134 SiCl4 Silane, tetrachloro- sicl4  
1135 CBrCl2F bromodichlorofluoromethane cbrcl2f  
1136 CF3I trifluoroiodomethane cf3i  
1137 CBrCl3 Methane, bromotrichloro- cbrcl3  
1138 CBr2F2 Methane, dibromodifluoro- cbr2f2  
1139 GeCl4 Germanium Tetrachloride gecl4  
1140 CBr2ClF dibromochlorofluoromethane cbr2clf  
1141 CBr2Cl2 dibromodichloromethane cbr2cl2  
1142 CCl3I trichloroiodomethane ccl3i  
1143 CFBr3 fluorotribromomethane cfbr3  
1144 CFClBrI fluorochlorobromoiodomethane cfclbri  
1145 CBr3Cl tribromochloromethane cbr3cl  
1146 CF2I2 difluorodiiodomethane cf2i2  
1147 CCl2I2 dichlorodiiodomethane ccl2i2  
1148 SiBr4 Silicon tetrabromide sibr4  
1149 CBr3I tribromoiododmethane cbr3i  
1150 GeBr4 Germanium tetrabromide gebr4  
1151 CI4 tetraiodomethane ci4  
1152 SiI4 silicon tetraiodide sii4  
1153 ClOF3 Chlorine trifluoride oxide clof3  
1154 SF4 Sulfur tetrafluoride sf4  
1155 SeF4 Selenium tetrafluoride sef4  
1156 SCl4 Sulfur tetrachloride scl4  
1157 C2HF3 Trifluoroethylene c2hf3  
1158 CHClCCl2 Trichloroethylene chclccl2  
1159 CHBrCF2 1-Bromo-2,2-difluoroethylene chbrcf2  
1160 HClO4 perchloric acid hclo4  
1161 HSO3F Fluorosulfonic acid hso3f  
1162 CF3OH trifluoromethanol cf3oh  
1163 CH2ClCCCl 1,3-dichloropropyne ch2clcccl  
1164 CHClCCHCl 1,3-dichloroallene chclcchcl  
1165 CHCl2CCH 3,3-dichloropropyne chcl2cch  
1166 PF3CH2 phosphorane, trifluoromethylene- pf3ch2  
1167 CH3CF3 Ethane, 1,1,1-trifluoro- ch3cf3  
1168 CHF2CH2F Ethane, 1,1,2-trifluoro ch2fchf2  
1169 CH3CFCl2 1,1-Dichloro-1-fluoroethane ch3cfcl2  
1170 CH2ClCHCl2 1,1,2-trichloroethane ch2clchcl2  
1171 CH3CCl3 Ethane, 1,1,1-trichloro- ch3ccl3  
1172 SiCl3CH3 methyltrichlorosilane sicl3ch3  
1173 CH3CBr3 1,1,1-tribromoethane ch3cbr3  
1174 NH3BCl3 Amminetrichloroboron nh3bcl3  
1175 SiH3CCl3 (trichloromethyl)silane sih3ccl3  
1176 CH2CClCHCH2 1,3-Butadiene, 2-chloro- c4h5cl  
1177 C3H5ClO Oxirane, (chloromethyl)- c106898  
1178 CH2FCH2CH2F 1,3-difluoropropane ch2fch2ch2f  
1179 CH3CF2CH3 2,2-difluoropropane ch3cf2ch3  
1180 CH2ClCH2CH2Cl 1,3-dichloropropane prdicl13  
1181 CH2ClCHClCH3 Propane, 1,2-dichloro- prdicl12  
1182 CH3CCl2CH3 Propane, 2,2-dichloro- prdicl22  
1183 CHCl2CH2CH3 1,1-dichloropropane prdicl11  
1184 SiCl2(CH3)2 dichlorodimethylsilane sicl2me2  
1185 CH2CClCH2CH3 1-Butene, 2-chloro- bute1cl2  
1186 CH2CHCH2CH2Cl 1-Butene, 4-chloro- bute1cl4  
1187 CH2CHCHClCH3 1-Butene, 3-chloro- bute1cl3  
1188 CH2ClCHCHCH3 2-Butene, 1-chloro- bute2cl1  
1189 CH3CClCHCH3 2-Butene, 2-chloro-, (E)- bute2cl2e  
1190 CH3CClCHCH3 2-Butene, 2-chloro-, (Z)- bute2cl2z  
1191 CHClCHCH2CH3 (E)-1-Chloro-1-butene bute1cl1  
1192 CHClCHCH2CH3 (Z)-1-Chloro-1-butene bute1cl1z  
1193 C4H9F 1-fluorobutane butaf1  
1194 CH3CHFCH2CH3 2-fluorobutane butaf2  
1195 CH2ClCH2CH2CH3 Butane, 1-chloro- butacl1  
1196 CH3CCl(CH3)CH3 Propane, 2-chloro-2-methyl- procl2me2  
1197 CH3CHClCH2CH3 Butane, 2-chloro- butacl2  
1198 XeF4 Xenon tetrafluoride xef4  
1199 C2H2N2O Furazan furazan  
1200 CF3PH2 phosphine, (trifluoromethyl)- cf3ph2  
1201 NH3BF3 Amminetrifluoroboron nh3bf3  
1202 C6H2 hexatriyne c6h2  
1203 C6H4 (E)-Hexa-1,5-diyne-3-ene c6h4e  
1204 C6H4 (Z)-Hexa-1,5-diyne-3-ene c6h4z  
1205 C6H4 Benzyne benzyne  
1206 C6H5- phenyl anion phenyl-  
1207 C6H6 Prismane prismane  
1208 C6H6 1,2,4,5-Hexatetraene ht1245  
1209 C6H6 2,4-Hexadiyne hexadiyne  
1210 C6H6 3,4-Dimethylenecyclobutene cb34m  
1211 C6H6 Benzene benzene  
1212 C6H6 Benzvalene bv  
1213 C6H6 Dewar Benzene dewar  
1214 C6H6 Hexa-1,5-diene-3-yne hdy153  
1215 C6H6 Trimethylenecycopropane tmcp  
1216 C6H6+ Benzene cation c6h6+  
1217 C6H7+ benzene, protonated c6h7+  
1218 C6H8 (E)-hexa-1,3,5-triene c821078  
1219 C6H8 (E)-hexa-2,3,4-triene c59660650  
1220 C6H8 (Z)-hexa-1,3,5-triene hexatri135  
1221 C6H8 (Z)-hexa-2,3,4-triene hetr234c  
1222 C6H8 1,3-Cyclohexadiene cyhexadiene13  
1223 C6H8 1,4-Cyclohexadiene cyhexadiene14  
1224 C6H8 3-Methylenecyclopentene c930267  
1225 C6H8 Bicyclo[2.1.1]hex-2-ene c822413  
1226 C6H8 Bicyclo[2.2.0]hex-1(4)-ene c30830207  
1227 C6H8 Bicyclo[3.1.0]hex-2-ene c694019  
1228 C6H10 1,3-Hexadiene, (E)- hexdi13e  
1229 C6H10 1,3-Hexadiene, (Z)- hexdi13z  
1230 C6H10 1,4-Hexadiene, (E)- hexdi14t  
1231 C6H10 1,4-Hexadiene, (Z)- hexdi14z  
1232 C6H10 1,5-Hexadiene c592427  
1233 C6H10 1-Butyne, 3,3-dimethyl- c917920  
1234 C6H10 1-Hexyne hexyne1  
1235 C6H10 2,4-Hexadiene, (E,E)- hexdi24ee  
1236 C6H10 2,4-Hexadiene, (E,Z)- hexdi24ez  
1237 C6H10 2,4-Hexadiene, (Z,Z)- hexdi24zz  
1238 C6H10 2-Hexyne c764352  
1239 C6H10 3-Hexyne hexyne3  
1240 C6H10 cyclohexene cyclohexene  
1241 C6H10 Cyclopentene, 1-methyl- c693890  
1242 C6H10 Cyclopentene, 3-methyl- c1120623  
1243 C6H10 Cyclopentene, 4-methyl- c1759815  
1244 C4H6(CH3)2 1,1-dimethylcyclobutane dmcb11  
1245 C6H12 (1R,2R)-1,2-dimethylcyclobutane dmcb12t  
1246 C6H12 (1r,3r)-1,3-dimethylcyclobutane dmcb13t  
1247 C6H12 (E)-2-Hexene e2hexene  
1248 C6H12 (E)-3-methylpent-2-ene c616126  
1249 C6H12 (E)-hex-3-ene e3hexene  
1250 C6H12 (Z)-3-methylpent-2-ene c922623  
1251 C6H12 (Z)-hex-2-ene z2hexene  
1252 C6H12 (Z)-hex-3-ene z3hexene  
1253 C6H12 2,3-dimethylbut-1-ene c563780  
1254 C6H12 2,3-dimethyl-but-2-ene tmeet  
1255 C6H12 3-methylenepentane c760214  
1256 C6H12 cis-1,2-dimethylcyclobutane dmcb12c  
1257 C6H12 cis-1,3-dimethylcyclobutane dmcb13c  
1258 C6H12 Cyclohexane cyclohexane  
1259 C6H12 Cyclopentane, methyl- c96377  
1260 C6H12 Ethylcyclobutane c4806615  
1261 C6H12 hex-1-ene hexene1  
1262 C6H14 Butane, 2,2-dimethyl- buta22  
1263 C6H14 Butane, 2,3-dimethyl- buta23  
1264 C6H14 Hexane hexane  
1265 C6H14 Pentane, 2-methyl- penta2  
1266 C6H14 Pentane, 3-methyl- penta3  
1267 C4N2 2-Butynedinitrile c4n2  
1268 N3P3 1,3,5,2,4,6-Triazatriphosphorine n3p3  
1269 C4H2N2 Fumaronitrile c4h2n2  
1270 C2H2N4 sym-tetrazine ttz  
1271 C3H3N3 1,3,5-Triazine triazine135  
1272 CH3N5 5-Aminotetrazole c4418615  
1273 C4H4N2 1,3-Diazine diazine13  
1274 C4H4N2 Pyrazine pyrazine  
1275 C4H4N2 Pyridazine pyridazine  
1276 C4H4N2 Succinonitrile c110612  
1277 C2H4N4 1H-Tetrazole, 1-methyl- c16681779  
1278 C2H4N4 1H-Tetrazole, 5-methyl- c4076362  
1279 C2H4N4 2H-Tetrazole, 2-methyl- c16681780  
1280 C5H5N Bicyclo[1.1.0]butane-1-carbonitrile bibucn  
1281 C5H5N E-2,4-pentadienenitrile bdcn  
1282 C5H5N Pyridine pyridine  
1283 B3N3H6 borazine borazine  
1284 C6H6 Fulvene fulvene  
1285 C5H6N+ Pyridinium c5h6n  
1286 C4H6N2 1H-Imidazole, 2-methyl- c693981  
1287 C5H7N (E)-2-Pentenenitrile c26294984  
1288 C5H7N (E)-3-Pentenenitrile c16529661  
1289 C5H7N (Z)-2-Pentenenitrile c25899507  
1290 C5H7N 1H-Pyrrole, 1-methyl- c96548  
1291 C5H7N Cyclobutanecarbonitrile c4426113  
1292 C5H9N 1,2,3,6-Tetrahydropyridine c694053  
1293 C5H9N Butanenitrile, 2-methyl- c18936179  
1294 C5H9N Pentanenitrile c110598  
1295 C5H9N Propanenitrile, 2,2-dimethyl- c630182  
1296 C6H10 Bicyclo[3.1.0]hexane c285585  
1297 C5H11N Cyclopentanamine cypentam  
1298 C5H11N Piperidine piper  
1299 C4H12N2 1,2-Butanediamine c4426486  
1300 C4H12N2 2-Methyl-1,2-propanediamine c811938  
1301 Li2CO3 Lithium Carbonate li2co3  
1302 Na2CO3 Sodium Carbonate na2co3  
1303 C2O4-- oxalate anion c2o4  
1304 MgSO4 Magnesium Sulfate mgso4  
1305 N2O4 Dinitrogen tetroxide n2o4  
1306 C3H2O3 vinylene carbonate vica  
1307 C2H2O4 Oxalic Acid oxalic  
1308 C2H3NO3 Oxamic acid oxamic  
1309 C4H4O2 2(5H)-Furanone furanone  
1310 C4H4O2 2-Oxetanone, 4-methylene- c674828  
1311 C2H4N2O2 Oxalamide oxalamide  
1312 C2H4N2S2 Ethanedithioamide c79403  
1313 C2H4CO3 Ethylene carbonate etco3  
1314 C3H4O2S 2H-Thiete-1,1-dioxide c7285327  
1315 C3H4S3 1,3-Dithiolane-2-thione c822388  
1316 C2H4O4 Formic acid dimer fadimer  
1317 C4H5NO 3-Methylisoxazole isox3m  
1318 C4H5NO Isoxazole, 5-methyl- c5765446  
1319 C4H5NS 4-Methylthiazole c693958  
1320 C2H5NO3 Nitric acid, ethyl ester c625581  
1321 C5H6O 2H-Pyran pyran2  
1322 C5H6O 2-methylfuran furan2m  
1323 C5H6O 3-Methylfuran furan3m  
1324 C5H6O Pentadienal pdal  
1325 C5H6S Thiophene, 2-methyl- c554143  
1326 C5H6S Thiophene, 3-methyl- c616444  
1327 C4H6O2 γ–Butyrolactone c96480  
1328 C4H6O2 2,3-Butanedione c431038  
1329 C4H6O2 2-Propenoic acid, methyl ester c96333  
1330 C4H6O2 Crotonic Acid crot  
1331 C4H6OS 2,3-dihydrothiophene-2-ol c9000117  
1332 C4H6OS 2,5-dihydrothiophene-3-ol c9000093  
1333 C4H6OS 4,5-dihydrothiophene-2-ol c9000106  
1334 C4H6OS 4,5-dihydrothiophene-3-ol c9000082  
1335 C4H6OS Dihydro-2-(3H)-thiophenone c1003107  
1336 C4H6OS Dihydro-3-(2H)-thiophenone c1003049  
1337 C4H6OS Vinyl sulfoxide c1115157  
1338 CH6N4S Carbonothioic dihydrazide thiacarb  
1339 C2H6N2O2 (E)-Azodioxymethane c37765154  
1340 C2H6N2O2 Dimethylnitroamine c4164287  
1341 C3H6O3 1,3,5-Trioxane trioxane  
1342 C3H6S3 1,3,5-Trithiane c3h6s3  
1343 C3H6S3 Carbonotrithioic acid, dimethyl ester c2314489  
1344 C2H6O3S Sulfurous acid, dimethyl ester c616422  
1345 C4H7NO 2-Pyrrolidinone c616455  
1346 C4H7NO Ethoxyacetonitrile etoaccn  
1347 C4H7NO Methacrylamide c79390  
1348 C4H7NO Oxazole, 4,5-dihydro-2-methyl- c1120645  
1349 HCONH2CN2H4 formamide aminomethanimine dimer d13  
1350 C3H7ONO Propyl nitrite prono  
1351 CH3CH(CH3)ONO Isopropyl nitrite c541424  
1352 CH3CH(NH2)COOH Alanine alanine  
1353 CH3NHCH2COOH Sarcosine sarcosine  
1354 NH2CH2CH2COOH β–alanine betaalanine  
1355 NH2COOC2H5 Urethane urethane  
1356 C5H8O 2H-Pyran, 3,4-dihydro- c110872  
1357 C5H8O Cyclopentanone c120923  
1358 C5H8O Furan, 2,3-dihydro-5-methyl- c1487156  
1359 C5H8O Methyl cyclopropyl ketone c765435  
1360 N(CH3)2CONH2 Urea, N,N-dimethyl- c598947  
1361 NH(CH3)CONH(CH3) Urea, N,N'-dimethyl- c96311  
1362 NH2CONHC2H5 Urea, ethyl- c625525  
1363 C4H8O2 1,3-Dioxane dioxan13  
1364 C4H8O2 1,3-Dioxolane, 2-methyl- c497267  
1365 C4H8O2 1,4-Dioxane dioxan14  
1366 C4H8O2 Ethene, 1,1-dimethoxy- c922690  
1367 C4H8O2 Ethyl acetate c141786  
1368 C4H8OS s-Ethyl thioacetate c625605  
1369 C3H8O3 1,2,3-Propanetriol glycerin  
1370 C3H8O2S (Methylsulfonyl)ethane c594434  
1371 C4H9NO Butanamide c541355  
1372 C4H9NO Propanamide, 2-methyl- c563837  
1373 C5H10O 2-Butanone, 3-methyl- c563804  
1374 C5H10O 2H-Pyran, tetrahydro- c142687  
1375 C5H10O 2-methylbutyraldehyde 2meba  
1376 C5H10O 2-Pentanone mpk  
1377 C5H10O 3-Pentanone dek  
1378 C5H10O Cyclopentanol c96413  
1379 C5H10O Oxetane, 3,3-dimethyl- c6921353  
1380 C5H10O Pentanal pal  
1381 C5H10S 2H-Thiopyran, tetrahydro- c1613510  
1382 C5H10S 3-Ethylthio-1-propene c5296628  
1383 C5H10S Cyclopentanethiol c1679078  
1384 C5H10S Thiophene, tetrahydro-2-methyl- c1795091  
1385 C5H10S Thiophene, tetrahydro-3-methyl- c4740005  
1386 C4H10O2 1,1-Dimethoxyethane c534156  
1387 C4H10O2 1,3-Butanediol budiol13  
1388 C4H10O2 1,4-Butanediol budiol14  
1389 C4H10O2 Ethane, 1,2-dimethoxy- c110714  
1390 C4H10OS Diethyl sulfoxide c70291  
1391 C4H10S2 1,4-Butanedithiol budisl14  
1392 C4H11NO Diethylhydroxylamine c3710847  
1393 C5H12O 1-Butanol, 2-methyl- c137326  
1394 C5H12O 1-Butanol, 3-methyl- c123513  
1395 C5H12O 1-Pentanol pentanol1  
1396 C5H12O 2-Butanol, 3-methyl- c598754  
1397 C5H12O 2-Pentanol peol2  
1398 C5H12O 3-Pentanol pentan3ol  
1399 C5H12O Butane, 1-methoxy- meobu  
1400 C5H12O Propane, 1-ethoxy- proet  
1401 C5H12O Propane, 2-methoxy-2-methyl- c1634044  
1402 C5H12S 1-Butanethiol, 2-methyl- c1878188  
1403 C5H12S 1-Butanethiol, 3-methyl- c541311  
1404 C5H12S 1-Pentanethiol c110667  
1405 C5H12S 1-Propanethiol, 2,2-dimethyl- c1679089  
1406 C5H12S 2-Butanethiol, 2-methyl- c1679090  
1407 C5H12S 2-Butanethiol, 3-methyl- c2084186  
1408 C5H12S Butane, 1-(methylthio)- c628295  
1409 C5H12S Ethyl propyl sulfide c4110503  
1410 C5H12S Propane, 2-(ethylthio)- c5145993  
1411 C5H12S Propane, 2-methyl-2-(methylthio)- c6163640  
1412 C4F2 difluorobutadiyne c4f2  
1413 ClCOClCO Oxalyl chloride oxcl  
1414 CF3CN Acetonitrile, trifluoro- cf3cn  
1415 CF3CN+ Acetonitrile, trifluoro- cation cf3cn+  
1416 B2F4 Diboron tetrafluoride b2f4  
1417 B2Cl4 Diboron tetrachloride b2cl4  
1418 C2F4 Tetrafluoroethylene c2f4  
1419 C2F4+ Tetrafluoroethylene cation c2f4+  
1420 C2ClF3 Ethene, chlorotrifluoro- c2f3cl  
1421 CF2CCl2 difluorodichloroethylene cf2ccl2  
1422 CFClCClF trans-1,2-dichloro-1,2-difluoroethylene cfclcclf  
1423 CFClCFCl cis-1,2-dichloro-1,2-difluoroethylene cfclcfcl  
1424 C2FCl3 fluorotrichloroethene c2fcl3  
1425 C2Cl4 Tetrachloroethylene c2cl4  
1426 C2Br4 tetrabromoethene c2br4  
1427 CF3OF Trifluoromethylhypofluorite cf3of  
1428 SiF5- silicon pentafluoride anion sif5-  
1429 SOF4 Sulfur tetrafluoride oxide sof4  
1430 PF5 Phosphorus pentafluoride pf5  
1431 AsF5 Arsenic pentafluoride asf5  
1432 PCl5 Phosphorus pentachloride pcl5  
1433 SF5+ pentafluoro sulfur cation sf5+  
1434 SbCl5 Antimony pentachloride sbcl5  
1435 BrF5 bromine pentafluoride brf5  
1436 ClF5 chlorinepentafluoride clf5  
1437 IF5 pentafluoroiodine if5  
1438 CHFClCHClF ethane, 1,2-dichloro-1,2-difluoro- chfclchclf  
1439 CF3CH2F 1,1,1,2-tetrafluoroethane cf3ch2f  
1440 CHF2CHF2 1,1,2,2-tetrafluoroethane chf2chf2  
1441 CHFClCHFCl 1,2-dichloro-1,2-difluoroethane RR chfclchfcl  
1442 CH2ClCCl3 1,1,1,2-tetrachloroethane ch2clccl3  
1443 CHCl2CHCl2 Ethane, 1,1,2,2-tetrachloro- chcl2chcl2  
1444 CH2BrCBr3 1,1,1,2-tetrabromo ethane c2h2br4  
1445 CHCl2CHF2 1,1-dichloro-2,2-difluoroethane c2h2cl2f2  
1446 CF3COOH trifluoroacetic acid cf3cooh  
1447 C4H3ClO Furan, 2-chloro fur2cl  
1448 C4H3ClO Furan,3-chloro fur3cl  
1449 C3H5ClO2 Carbonochloridic acid, ethyl ester c541413  
1450 C3H5Cl3 Propane, 1,2,3-trichloro- prcl135  
1451 C4H8Cl2 1,4-Dichlorobutane c110565  
1452 C4H8Cl2 Butane, 1,2-dichloro- c616217  
1453 C4H8Cl2 Butane, 1,3-dichloro- c1190223  
1454 C4H8Cl2 Butane, 2,3-dichloro-, (r*,r*)-(.+/-.)- c2211678  
1455 C4H8Cl2 Butane, 2,3-dichloro-, (r*,s*)- c4028562  
1456 C4H9ClO 1-Chloro-2-ethoxyethane c628342  
1457 C5H11Cl Pentane, 1-chloro- pencl1  
1458 C4H8O2 Butanoic acid bua  
1459 C7H7+ cycloheptatrienyl cation c7h7+  
1460 C6H5CH3 toluene toluene  
1461 C7H8 cycloheptatriene cht  
1462 C7H8 Norbornadiene norbor  
1463 C7H8 Quadricyclane qucy  
1464 C7H12 Norbornane nor  
1465 C7H14 cycloheptane c7h14  
1466 C7H16 2-methylhexane 2mhex  
1467 C7H16 3-methylhexane hex3m  
1468 C7H16 heptane heptane  
1469 CH(CN)3 tricyanomethane mecn3  
1470 HN=C=C(CN)2 Dicyanoketenimine c4hn3  
1471 C6H7N 2-Methylpyridine mp  
1472 C6H5NH2 aniline aniline  
1473 C6H13N 2-Methylpiperidine pip2m  
1474 C6H15N triethylamine tea  
1475 N2O5 Dinitrogen pentoxide n2o5  
1476 C4H2O3 Maleic Anhydride malan  
1477 C5H4O2 4-Cyclopentene-1,3-dione cpdio  
1478 C5H4O2 furfural furfural  
1479 C5H5NO 2(1H)-Pyridinone c72762006  
1480 C5H5NO 2(3H)-Pyridinone c9000048  
1481 C5H5NO 2(5H)-Pyridinone c9000037  
1482 C5H5NO 2-Pyridinol c109104  
1483 C5H5NO 3(2H)-Pyridinone c9000004  
1484 C5H5NO 3(4H)-Pyridinone c9000026  
1485 C5H5NO 3(6H)-Pyridinone c9000015  
1486 C5H5NO 3-Pyridinol c109002  
1487 C5H5NO 4(1H)-Pryidinone c9000060  
1488 C5H5NO 4(3H)-Pryidinone c9000059  
1489 C5H5NO 4-Pyridinol c626642  
1490 C6H5OH phenol phenol  
1491 C6H6O 2,4-Cyclohexadienone c24599573  
1492 C6H6O 2,5-Cyclohexadienone c5664335  
1493 C6H5SH Benzenethiol phsh  
1494 HO2CCHNH2CH2OH Serine serine  
1495 C5H8O2 Acetylacetone acac  
1496 C4H8O2S Sulfolane sulfolane  
1497 C7H10 Norbornene norbornene  
1498 CH(C2H3)3 trivinyl methane tvm  
1499 C6H10O cyclohexanone chexo  
1500 C6H12O hexanal c6h12o  
1501 C6H12O Oxepane oxepane  
1502 C3H7OC3H7 di-n-propyl ether propr  
1503 F2CCCF2 tetrafluoroallene pfa  
1504 CF3COO- trifluoro acetate anion cf3coo-  
1505 CF3COF trifluoroacetyl fluoride cf3cof  
1506 CF3COCl trifluoroacetyl chloride cf3cocl  
1507 PF6- Hexafluorophosphate ion pf6-  
1508 SF6 Sulfur Hexafluoride sf6  
1509 SeF6 Selenium hexafluoride sef6  
1510 SF5Cl sulfur chloropentafluoride sf5cl  
1511 CF3CHF2 pentafluoroethane cf3chf2  
1512 CF3CHFCl 1,1,1,2-tetrafluorochloroethane cf3chfcl  
1513 CF3CHCl2 1,1-Dichloro-2,2,2-trifluoroethane cf3chcl2  
1514 CHCl2CClF2 Ethane, 1,2,2-trichloro-1,1-difluoro- chcl2cclf2  
1515 CCl3CHCl2 pentachloroethane ccl3chcl2  
1516 C6H5F Fluorobenzene bzf  
1517 C6H5Cl chlorobenzene bzcl  
1518 C6H5Br bromobenzene bzbr  
1519 C8H6 Calicene calicene  
1520 C6H5CCH phenylacetylene phac  
1521 C8H6 benzocyclobutadiene bcbd  
1522 C8H6 Pentalene pentalene  
1523 C6H5CHCH2 Styrene styrene  
1524 C8H8 cubane cubane  
1525 C8H8 cyclooctatetraene cot  
1526 C6H5CH2CH3 Ethylbenzene etbz  
1527 CH3C6H4CH3 meta-xylene mxylene  
1528 CH3C6H4CH3 paraxylene pxylene  
1529 C8H14 Bicyclo[2.2.2]octane bico222  
1530 C8H16 cyclooctane cyclooct  
1531 (CH3)3CC(CH3)3 tetramethylbutane tmb  
1532 C8H18 Octane c8h18  
1533 C6H5CN phenyl cyanide phcn  
1534 C6H12N2 Triethylenediamine ted  
1535 C4O4-- squarate dianion c4o4--  
1536 S4N4 Tetrasulfur tetranitride s4n4  
1537 S8 Octasulfur s8  
1538 C6H4O2 parabenzoquinone pbq  
1539 C4H4N2O2 Uracil uracil  
1540 C6H5CHO benzaldehyde benzal  
1541 C6H5OCH3 Anisole anisole  
1542 C5H9NO2 Proline proline  
1543 C4F4 tetrafluorcyclobutadiene c4f4  
1544 Al2Cl6 Aluminum, di-μ-chlorotetrachlorodi- al2cl6  
1545 CF3CFCl2 1,1-Dichlorotetrafluoroethane cf3cfcl2  
1546 CF2ClCFCl2 Ethane, 1,1,2-trichloro-1,2,2-trifluoro- cf2clcfcl2  
1547 CF3CCl3 1,1,1-trifluoro-2,2,2-trichloroethane cf3ccl3  
1548 C2F6 hexafluoroethane c2f6  
1549 C2Cl6 hexachloroethane c2cl6  
1550 IF7 Iodine heptafluoride if7  
1551 C6H4F2 metadifluorobenzene mdfb  
1552 C6H4F2 orthodifluorobenzene odfb  
1553 C6H4F2 1,4-difluorobenzene pdfb  
1554 C6H4Cl2 1,2-dichlorobenzene dcb12  
1555 C6H4Cl2 1,3-dichlorobenzene dcb13  
1556 C6H4Cl2 1,4-dichlorobenzene dcb14  
1557 C6H5NO nitrosobenzene bzno  
1558 C9H8 Indene indene  
1559 C9H8 spiro[4.4]nona-1,3,6,8-tetraene snt  
1560 C9H12 n-propyl benzene prbz  
1561 C9H20 Nonane nonane  
1562 C(CN)4 tetracyanomethane c5n4  
1563 C5H4N4 purine purine  
1564 C8H7N Indole indole  
1565 C3H3N3O3 cyanuric acid cyanuric  
1566 C6H5NO2 Nitrobenzene c6h5no2  
1567 C6H5COOH benzoic acid benzo  
1568 CH3COC6H5 acetophenone acph  
1569 C3Cl3N3 1,3,5-Triazine, 2,4,6-trichloro- c3cl3n3  
1570 C3F6 hexafluoropropene c3f6  
1571 C6H3F3 Benzene trifluoride 123 bzf3a  
1572 C8H18O 1-Octanol octanol  
1573 C10H8 Azulene azu  
1574 C10H8 naphthalene naph  
1575 C10H10 bullvalene bullv  
1576 C10H16 adamantane adamantane  
1577 C6N4 Tetracyanoethylene tcne  
1578 C10H22 Decane decane  
1579 C4F6 perfluorobutadiene c4f6  
1580 SF5CF3 Sulfur, pentafluoro(trifluoromethyl)- sf5cf3  
1581 C3F8 perfluoropropane c3f8  
1582 Fe(CO)5 Iron pentacarbonyl ipc  
1583 Fe(C5H5)2 ferrocene fecp2  
1584 B12H12-- Dodecahydrododecaborate(2-) b12h12--  
1585 B12H12-- Dodecahydrododecaborate(2-) b12h12--  
1586 C12H8 Acenaphthylene acenaph  
1587 C12H8 biphenylene biph  
1588 C12H10 biphenyl biphenyl  
1589 C12H10 Heptalene heptalene  
1590 C6H12O6 Inositol inositol  
1591 C6F6 hexafluorobenzene c6f6  
1592 S2F10 disulphur decafluoride s2f10  
1593 C13H10 Fluorene fluorene  
1594 C14H10 Anthracene anth  
1595 C14H10 Phenanthrene phenanthrene  
1596 C14H14 Bibenzyl bibenzyl  
1597 C12H10N2 azobenzene azobenzene  
1598 C6H5COC6H5 benzophenone benzophenone  
1599 C16H10 Pyrene pyrene  
1600 C18H12 Tetracene tetracene  
1601 C19H16 Triphenylmethane tpm  
1602 C24H12 Coronene coronene  
1603 C60 Buckminsterfullerene c60