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List of which calculations are completed at CCSD(T) /6-311+G(3df,2p)

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count Species Name State Conformation
1 H Hydrogen atom 1SKh
2 H+ Hydrogen atom cation  Kh
3 D2 Deuterium diatomic 1ΣgD∞h
4 H2 Hydrogen diatomic 1ΣgD∞h
5 HD Deuterium hydride 1ΣgD∞h
6 He Helium atom 1SKh
7 He Helium atom   
8 He+ Helium atom cation 2SKh
9 HeH+ Helium hydride cation 1ΣC∞v
10 He2+ helium diatomic cation 2ΣuD∞h
11 Li Lithium atom 2SKh
12 Na Sodium atom 2SKh
13 K Potassium atom 2SKh
14 Cu Copper atom 2SKh
15 LiH Lithium Hydride 1ΣC∞v
16 NaH sodium hydride 1ΣC∞v
17 KH Potassium hydride 1ΣC∞v
18 CuH Copper monohydride 1ΣC∞v
19 Be Beryllium atom 1SKh
20 Be+ Beryllium atom cation 2SKh
21 Mg Magnesium atom 1SKh
22 Mg+ Magnesium atom cation 2SKh
23 Zn Zinc atom 1SKh
24 BeH beryllium monohydride 2ΣC∞v
25 MgH magnesium monohydride 2ΣC∞v
26 ZnH+ Zinc, protonated   
27 BeH2+ Beryllium dihydride cation   
28 CaH2 Calcium Hydride 1ΣgD∞h
29 CaH2 Calcium Hydride 1A1C2v
30 B Boron atom 2PKh
31 B Boron atom 4PKh
32 B+ Boron atom cation 1SKh
33 Al Aluminum atom 2PKh
34 Al- Aluminum atom anion 3PKh
35 Al+ Aluminum atom cation 1SKh
36 Ga Gallium atom 2P 
37 Ga- Gallium atom anion 3POh
38 Ga+ Gallium atom cation 1S 
39 BH Boron monohydride 1ΣC∞v
40 GaH Gallium monohydride 1ΣC∞v
41 GaH+ Gallium monohydride cation 2ΣC∞v
42 BH3+ boron trihydride cation 2B2C2v
43 BH3+ boron trihydride cation  C2v
44 AlH3- aluminum trihydride anion  C3v
45 BH4- borohydride anion 1A1Td
46 C Carbon atom 3P0Kh
47 C Carbon atom 3P1Kh
48 C+ Carbon atom cation 2PKh
49 Si Silicon atom 3PKh
50 Si Silicon atom 1SKh
51 Si- Silicon atom anion 4SKh
52 Si+ Silicon atom cation 2PKh
53 Ge Germanium atom 3PKh
54 Ge- Germanium anion 4SKh
55 Ge+ Germanium cation 2PKh
56 CH Methylidyne 2Π1/2C∞v
57 SiH Silylidyne 2ΠC∞v
58 GeH germylidene 2ΠC∞v
59 CH2- methylene anion 2B1C2v
60 GeH2 germylene 1A1C2v
61 SiH3 Silyl radical 2A1C3v
62 SiH3+ Silyl cation 1A1'D3h
63 GeH3 Germyl radical 2A1C3v
64 GeH3+ germyl cation 1A1'D3h
65 CH4 Methane 1A1Td
66 SiH2D2 silane-d2   
67 GeH4 Germane 1A1Td
68 SiH5+ Silane, protonated   
69 N Nitrogen atom 4SKh
70 N+ Nitrogen atom cation 3PKh
71 P Phosphorus atom 4SKh
72 V+ Vanadium atom cation 5DKh
73 As Arsenic atomic 4SKh
74 As- Arsenic anion 3PKh
75 As+ Arsenic cation 3PKh
76 NH Imidogen 3Σ-C∞v
77 PH phosphorus monohydride 3Σ-C∞v
78 AsH Arsenic monohydride 3ΣC∞v
79 NH2 Amino radical 2B1C2v
80 NH2+ Amino cation 3B1C2v
81 NH2+ Amino cation 1A1C2v
82 NH3 Ammonia 1A1C3v
83 PH3 Phosphine 1A1C3v
84 PH3+ Phosphine cation 2A1C3v
85 AsH3+ Arsine cation 2A1C3v
86 AsH4+ Arsonium   
87 NH4 Ammonium radical   
88 PH4 Phosphoranyl radical   
89 O Oxygen atom 3SKh
90 O+ Oxygen atom cation 4SKh
91 S Sulfur atom 3PKh
92 S Sulfur atom   
93 Se Selenium atom 3PKh
94 Se- Selenium atom anion 2PKh
95 Se+ Selenium atom cation 4SKh
96 DO Hydroxyl-d 2ΠC∞v
97 OH Hydroxyl radical 2ΠC∞v
98 OH+ hydoxyl cation 3ΣC∞v
99 DS Mercapto-d 2ΠC∞v
100 HS Mercapto radical 2ΠC∞v
101 HS- mercapto anion 1ΣC∞v
102 HS+ sulfur monohydride cation 3ΣC∞v
103 CrH+ Chromium hydride cation 5ΣC∞v
104 HSe Selenium monohydride 2ΠC∞v
105 HSe- selenium monohydride anion 1ΣC∞v
106 HSe+ selenium monohydride cation 3ΣC∞v
107 H2O Water 1A1C2v
108 H2O- water anion 2A1C2v
109 H2O- water anion 2A'Cs
110 H2O+ water cation 2B1C2v
111 HDO Water-d1 1A1C2v
112 H2S+ Hydrogen sulfide cation 2B1C2v
113 H2Se Hydrogen selenide 1A1C2v
114 H2Se+ Hydrogen selenide cation 2B1C2v
115 H3S+ Sulfonium cation 1A1C3v
116 H3Se+ Hydrogen Selenide, protonated 1A1C3v
117 F Fluorine atom 2PKh
118 F+ Fluorine atom cation 3SKh
119 Cl Chlorine atom 2PKh
120 Cl+ Chlorine atom cation 3PKh
121 Br Bromine atom 2PKh
122 Br- Bromine atom anion 1SKh
123 Br+ Bromine atom cation 3PKh
124 DF Hydrofluoric acid-d 1ΣC∞v
125 HF Hydrogen fluoride 1ΣC∞v
126 HF- hydrogen fluoride anion 2ΣC∞v
127 HF+ hydrogen fluoride cation 2ΠC∞v
128 DCl Hydrochloric acid-d 1ΣC∞v
129 HCl Hydrogen chloride 1ΣC∞v
130 HCl- hydrogen chloride anion 2ΣC∞v
131 HCl+ hydrogen chloride cation 2ΠC∞v
132 HBr hydrogen bromide 1ΣC∞v
133 HBr- hydrogen bromide anion 2ΣC∞v
134 HBr+ hydrogen bromide cation 2ΠC∞v
135 H2Cl+ dihydrogen monochloride cation 1A1C2v
136 H2Br+ protonated hydrogen bromide 2A1C2v
137 Ne Neon atom 1SKh
138 Ne Neon atom   
139 Ne+ Neon atom cation 2PKh
140 Ar Argon atom 1SKh
141 Kr Krypton atom 1SKh
142 Kr+ Krypton cation 2PKh
143 HeLi+ Helium Lithium cation   
144 ArH+ Argon hydride cation 1ΣC∞v
145 KrH+ Protonated Krypton 1ΣC∞v
146 Li2 Lithium diatomic 1ΣgD∞v
147 NaLi lithium sodium 1ΣC∞v
148 Na2 Sodium diatomic 1ΣgD∞h
149 Na2- sodium diatomic anion 2ΣuD∞h
150 Be2 Beryllium diatomic 3ΠgD∞h
151 Mg2 Magnesium diatomic 1ΣgD∞h
152 LiAl Lithium Aluminum   
153 B2 Boron diatomic 3ΣgD∞h
154 Al2 Aluminum diatomic 3ΣgD∞h
155 HBBH Diborane(2) 3ΣGD∞h
156 B2H4 Diborane(4) D2d 1A1D2d
157 B2H6 Diborane 1AgD2h
158 B2H6+ Diborane cation   
159 CaC Calcium monocarbide   
160 BSi Boron silicide 4ΣC∞v
161 BSi Boron silicide 2ΣC∞v
162 C2 Carbon diatomic 1Σg+D∞h
163 Si2 Silicon diatomic 3ΣgD∞h
164 GeC Germanium monocarbide 1ΣC∞v
165 SiGe Silicon Germanium   
166 C2H- Ethynyl anion 1ΣC∞v
167 C2H2 Acetylene 1ΣgD∞h
168 C2H2+ acetylene cation 2ΠuD∞h
169 C2H2+ acetylene cation   
170 H2CC- vinylidene anion   
171 HCCH- acetylene anion   
172 HCCH- acetylene anion   
173 Si2H2 disilyne   
174 Si2H2 disilyne   
175 Si2H2 disilyne   
176 Si2H2 disilyne   
177 CH3Li methyl lithium 1A1C3v
178 C2H3 vinyl 2A'Cs
179 C2H3+ vinyl cation 1A1C2V bridging H
180 C2H3+ vinyl cation 1A1C2V HCCH2
181 C2H4 Ethylene 1AgD2h
182 C2H4+ Ethylene cation 2B3D2
183 Si2H4 Disilene   
184 Si2H4 Disilene   
185 Si2H4 Disilene   
186 C2H5 Ethyl radical 2A'Cs
187 C2H6 Ethane 1A1gD3d
188 Si2H6 disilane 1EuD3d
189 LiN Lithium Nitride 3ΣC∞v
190 LiP Lithium monophosphide   
191 LiP Lithium monophosphide   
192 MgN Magnesium Nitride   
193 MgN Magnesium Nitride   
194 GaAs Gallium arsenide 3Π 
195 GaAs Gallium arsenide 1Σ 
196 BN boron nitride 3ΠC∞v
197 CN Cyano radical 2ΣC∞v
198 CP Carbon monophosphide 2ΣC∞v
199 SiN Silicon nitride 2ΣC∞v
200 SiP Silicon monophosphide 2ΠC∞v
201 N2 Nitrogen diatomic 1ΣgD∞h
202 N2 Nitrogen diatomic   
203 PN Phosphorus mononitride 1ΣC∞v
204 P2 Phosphorus diatomic 1ΣgD∞h
205 HCN Hydrogen cyanide 1ΣC∞v
206 HCN+ hydrogen cyanide cation 2ΠC∞v
207 HNC+ hydrogen isocyanide cation   
208 HCP+ Phosphaethyne cation   
209 NNH+ Dinitrogen monohydride cation 1ΣC∞v
210 LiNH2 lithium amide   
211 HBNH Boranimine 1ΣC∞v
212 H2NN Isodiazene   
213 N2H2+ trans-diazene cation 2AGC2h
214 CH2NH Methanimine 1A'Cs
215 CH2NH+ Methanimine cation   
216 CHNH2 aminomethylene   
217 CHNH2+ Aminocarbene cation   
218 BH2NH2 Boranamine   
219 N2H4 Hydrazine 1AC2
220 CH3NH2 methyl amine 1A'Cs
221 SiH3NH2 Silane, amino   
222 BH3PH3 borane phosphine   
223 CH3NH3 methyl ammonium radical 2A1C3v
224 N2H7+ ammonia ammonium dimer   
225 LiO lithium oxide 2ΣC∞v
226 NaO sodium monoxide 2ΣC∞v
227 LiSe Lithium monoselenide   
228 BeO beryllium oxide 1ΣC∞v
229 BeS beryllium sulfide 1ΣC∞v
230 MgO magnesium oxide 1Σ+C∞v
231 CaO Calcium monoxide 1ΣC∞v
232 MgS magnesium sulfide 1ΣC∞v
233 CaS Calcium sulfide 1ΣC∞v
234 BO boron monoxide 2ΣC∞v
235 BS boron sulfide 2ΣC∞v
236 AlS Aluminum sulfide 2ΣC∞v
237 GaO Gallium monoxide 2ΣC∞v
238 GaS Gallium monosulfide   
239 CO Carbon monoxide 1ΣC∞v
240 CO- carbon monoxide anion 2ΠC∞v
241 CO+ carbon monoxide cation 2ΣC∞v
242 CS carbon monosulfide 1ΣC∞v
243 SiO Silicon monoxide 1ΣC∞v
244 SiS silicon monosulfide 1ΣC∞v
245 CSe Carbon monoselenide 1ΣC∞v
246 GeO Germanium monoxide 1ΣC∞v
247 SiSe Silicon Monoselenide   
248 SiSe+ Silicon Monoselenide cation   
249 GeSe Germanium monoselenide   
250 NO Nitric oxide 2ΠC∞v
251 NO- nitric oxide anion 3ΣC∞v
252 NO+ nitric oxide cation 1ΣC∞v
253 NS Mononitrogen monosulfide 2ΠC∞v
254 PO Phosphorus monoxide 2ΠC∞v
255 PS phosphorus sulfide 2ΣC∞v
256 NSe Nitrogen monoselenide 2ΠC∞v
257 AsS Arsenic monosulfide 2ΠC∞v
258 PSe Phosphorus monoselenide 2ΠC∞v
259 AsSe Arsenic monoselenide 2ΠC∞v
260 O2 Oxygen diatomic 3ΣgD∞h
261 O2-- dioxygen dianion   
262 SO Sulfur monoxide 3ΣC∞v
263 SO Sulfur monoxide 1ΣC∞v
264 SO+ sulfur monoxide cation 2ΠC∞v
265 S2 Sulfur diatomic 3ΣgD∞h
266 SeO Selenium monoxide 3ΣC∞v
267 Se2 Selenium diatomic 3ΣgD∞h
268 LiOH lithium hydroxide 1ΣC∞v
269 KOH Potassium hydroxide 1ΣC∞v
270 BeOH beryllium monohydroxide 2A'Cs
271 HBO Boron hydride oxide 1ΣC∞v
272 HBS hydrogen boron sulfide 1ΣC∞v
273 COH Hydroxymethylidyne   
274 HCO Formyl radical 2A'Cs
275 HCO- formyl anion 1A'Cs
276 HCO+ Formyl cation 1ΣC∞v
277 HNO Nitrosyl hydride 1A'Cs
278 HNO+ Nitrosyl hydride cation 2A'Cs
279 HSO+ Sulfur Monoxide, S-protonated   
280 SOH Sulfur Hydroxide   
281 SOH+ Sulfur Monoxide, protonated   
282 H2CO Formaldehyde 1A1C2v
283 H2CO- formaldehyde anion 2A'Cs
284 H2CO- formaldehyde anion   
285 H2CO+ formaldehyde cation 2B2C2v
286 H2CS Thioformaldehyde 1A1C2v
287 H2CS- thioformaldehyde anion   
288 H2CS- thioformaldehyde anion   
289 H2CSe Selenoformaldehyde   
290 H2O2 Hydrogen peroxide 1AC2
291 H2O2 Hydrogen peroxide 1AgC2h
292 H2OO water oxide   
293 HOSH hydrogen thioperoxide   
294 H2Se2 hydrogen diselenide   
295 CH2OH+ hydroxymethyl cation 1A'Cs
296 CH3O- methoxy anion 1A1C3v
297 NH2OH hydroxylamine 1A'Cs
298 NH2OH+ Hydroxylamine cation   
299 NH2SH Thiohydroxylamine   
300 NH2SH Thiohydroxylamine   
301 NH3S sulfidoazane   
302 CH3OH Methyl alcohol 1A'Cs
303 CH3OH+ Methyl alcohol cation 2A"Cs
304 SiH3OH silanol   
305 NH2OH2+ protonated hydroxylamine   
306 NH3OH+ N-protonated hydroxylamine   
307 H5O2+ Dihydroxonium ion 1AC2
308 LiF lithium fluoride 1ΣC∞v
309 LiCl lithium chloride 1ΣC∞v
310 NaF sodium fluoride 1ΣC∞v
311 NaF+ sodium fluoride cation 2ΣC∞v
312 NaCl Sodium Chloride 1ΣC∞v
313 CuF Copper monofluoride 1ΣC∞v
314 LiBr Lithium Bromide 1ΣC∞v
315 NaBr Sodium Bromide 1ΣC∞v
316 LiF+ lithium fluoride cation 2ΠC∞v
317 BeF Beryllium monofluoride 2ΣC∞v
318 BeCl beryllium monochloride 2ΣC∞v
319 MgF Magnesium monofluoride 2ΣC∞v
320 MgCl magnesium monochloride 2ΣC∞v
321 CaBr Calcium monobromide   
322 BF Boron monofluoride 1ΣC∞v
323 AlF Aluminum monofluoride 1Σ+C∞v
324 BCl boron monochloride 1ΣC∞v
325 GaF Gallium monofluoride 1ΣC∞v
326 AlBr Aluminum monobromide   
327 GaCl Gallium monochloride 1ΣGC∞v
328 GaBr Gallium monobromide   
329 CF Fluoromethylidyne 2ΠC∞v
330 CCl carbon monochloride 2ΠC∞v
331 SiF silicon monofluoride 2ΠC∞v
332 SiCl Clorosilylidyne 2ΠC∞v
333 CBr Carbon monobromide 2ΠC∞v
334 GeF Germanium monofluoride 2ΠC∞v
335 GeCl Germanium monochloride 2ΠC∞v
336 GeCl+ Germanium monochloride cation   
337 SiBr Silicon monobromide 2ΠC∞v
338 SiBr+ Silicon monobromide cation   
339 NF nitrogen fluoride 3ΣC∞v
340 NCl nitrogen monochloride 3ΣC∞v
341 PF phosphorus monofluoride 3ΣC∞v
342 PCl phosphorus chloride 3ΣC∞v
343 PBr Phosphorus monobromide   
344 FO Oxygen monofluoride 2ΠC∞v
345 ClO Monochlorine monoxide 2ΠC∞v
346 ClO+ chlorine monoxide cation 3ΣC∞v
347 SF Monosulfur monofluoride 2ΠC∞v
348 SF+ sulfur monofluoride cation 3ΣC∞v
349 SCl sulfur monochloride 2ΠC∞v
350 SCl+ sulfur monochloride cation 3ΣgC∞v
351 BrO Bromine monoxide 2ΠC∞v
352 BrO+ Bromine monoxide cation   
353 SBr Sulfur monobromide radical   
354 SBr+ Sulfur monobromide cation   
355 SeBr Selenium monobromide   
356 BrCl Bromine monochloride 1ΣC∞v
357 F2 Fluorine diatomic 1ΣgD∞h
358 F2+ flourine diatomic cation 2ΠgD∞h
359 ClF Chlorine monofluoride 1Σ+C∞v
360 ClF+ clorine monofluoride cation 2ΠC∞v
361 Cl2 Chlorine diatomic 1ΣgD∞h
362 Cl2+ chlorine diatomic cation 2ΠgD∞h
363 BrF Bromine monofluoride 1ΣC∞v
364 Br2 Bromine diatomic 1ΣgD∞h
365 Br2- bromine diatomic anion 2ΣuD∞h
366 Br2+ bromine diatomic cation 2ΠgD∞h
367 HCF Fluoromethylene 1A'Cs
368 HCF Fluoromethylene 3A"Cs
369 HSiF fluorosilylene   
370 HSiCl Chlorosilylene   
371 HSiBr monobromosilylene   
372 HOF Hypofluorous acid 1A'Cs
373 HOCl hypochlorous acid 1A'Cs
374 HOCl+ hypochlorous acid cation   
375 F2H+ Fluorine, protonated 1A'Cs
376 ClFH+ Chlorine fluoride, F-protonated   
377 FClH+ Chlorine fluoride, Cl-protonated   
378 Cl2H+ Chlorine, protonated 1A'Cs
379 CH2Br bromomethyl radical   
380 CH2F fluoromethyl radical 2ACs
381 CH2F+ fluoromethyl cation   
382 CH2Cl+ chloromethyl cation   
383 CH2Cl chloromethyl radical 2A'Cs
384 CH2Cl chloromethyl radical 2B1C2v
385 NH2Cl chloramine 1A'Cs
386 CH3F+ methyl fluoride cation   
387 CH3Cl Methyl chloride 1A1C3v
388 CH3Cl+ Methyl chloride cation   
389 SiH3F monofluorosilane 1A1C3v
390 SiH3Cl chlorosilane 1A1C1
391 CH3Br methyl bromide 1A1C3v
392 GeH3F monofluorogermane   
393 GeH3Cl monochlorogermane   
394 NH3Cl+ protonated monochloroammonia   
395 CH3ClH+ methyl chloride, protonated   
396 NH4Cl Ammonium chloride   
397 LiNe+ Lithium Neon cation   
398 Ar2 Argon diatomic 1SgD∞h
399 C3 carbon trimer 1ΣgD∞h
400 C3 carbon trimer 1A1C2v
401 SiC2 Silicon dicarbide   
402 C3H4 cyclopropene 1A1C2v
403 CH2CCH2 allene 1A1D2d
404 CH3CCH propyne 1A'C3v
405 C3H5 Allyl radical 2A2C2v
406 C3H6 Cyclopropane 1A1'D3h
407 CH2CHCH3 Propene 1A'Cs
408 C3H7 n-Propyl radical 2A"C1
409 CH3CHCH3 Isopropyl radical 2AC2
410 CH3CHCH3+ Isopropyl cation 1AC2
411 C3H8 Propane 1A1C2v
412 Si3H8 trisilane   
413 LiCN lithium cyanide 1ΣC*V LiCN
414 KCN Potassium cyanide 1ΣC∞v
415 KCN Potassium cyanide 1ΣC∞v
416 KCN Potassium cyanide 1A'Cs
417 ZnCN Zinc monocyanide 2ΣC∞v
418 ZnNC Zinc isocyanide 2ΣC∞v
419 AlCN Aluminum monocyanide   
420 AlNC Aluminum isocyanide   
421 CNN Diazocarbene   
422 N3 azide radical 2ΠgD∞h
423 HN3 hydrogen azide 1A'Cs
424 HN3+ Hydrazoic acid cation   
425 HNCNH diiminomethane 1AC2
426 HNNNH+ 1,2-Triazadienium   
427 NH2NN+ hydrazoic acid, protonated   
428 CH3CN Acetonitrile 1A1C3v
429 CH3CN- acetonitrile anion 2EC3v
430 CH3CN- acetonitrile anion 2A'Cs
431 CHNCH2 2H-Azirine   
432 CHNHCH 1H-Azirine   
433 H2CCNH Ethenimine   
434 H2CNCH methyleneaminomethylene   
435 HCCNH2 Ethynamine   
436 HCNCH2+ 2H-Azirine cation   
437 NH2CNH+ cyanamide, cn protonated   
438 NH3CN+ cyanamide, amine protonated   
439 C2H6N+ aziridine, protonated 1A1C2v
440 CH3CH2NH2 Ethylamine   
441 Li2O dilithium oxide 1ΣgD∞h
442 Na2O disodium monoxide 1ΣgLinear
443 Na2O disodium monoxide 1A1C2v
444 Na2S Sodium sulfide   
445 Na2S Sodium sulfide   
446 LiO2 Lithium dioxide   
447 NaO2 Sodium superoxide   
448 NCO isocyanato radical 2ΠC∞v
449 N2O Nitrous oxide 1ΣC∞v
450 CO2 Carbon dioxide 1ΣgD∞h
451 OCS Carbonyl sulfide 1ΣC∞v
452 CS2 Carbon disulfide 1ΣgD∞h
453 TiO2 Titanium dioxide 1A1C2v
454 GeO2 Germanium dioxide 1ΣgD∞h
455 OCSe Carbonyl selenide 1ΣC∞v
456 SCSe Carbon sulfide selenide   
457 NSO sulfinyl amidogen   
458 SNO Nitrogen oxide sulfide   
459 O3 Ozone 1A1Cs
460 SO2 Sulfur dioxide 1A1C2v
461 SSO Disulfur monoxide 1A'Cs
462 S3 Sulfur trimer 1A1C2v
463 S3 Sulfur trimer   
464 SeO2 Selenium dioxide 1A1C2v
465 HCCO ketenyl radical 2ΠC∞v
466 HCCO ketenyl radical 2A"Cs
467 HCNO fulminic acid 1ΣC∞v
468 HNCS Isothiocyanic acid   
469 HSCN thiocyanic acid 1A'Cs
470 HOCO Hydrocarboxyl radical 1A'cis
471 HOCO Hydrocarboxyl radical 1A'trans
472 O3H+ protonated ozone 1A'Cs
473 O3H+ protonated ozone   
474 C2H2O Oxirene 1A1C2v
475 CH2CO Ketene 1A1C2v
476 CH2CS Thioketene   
477 Be(OH)2 Beryllium hydroxide   
478 Be(OH)2 Beryllium hydroxide   
479 H2COO Dioxymethyl radical 2A'Cs
480 H2COO+ dioxymethyl cation 2A'Cs
481 HCOOH Formic acid 1A'Cs
482 HCOOH Formic acid   
483 BH3CO Borane carbonyl 1A1C3v
484 CH2COH+ ketene, protonated   
485 HOCHNH hydroxymethylimine 1A'CS H all up
486 CHSNH2 thioformamide   
487 NHCHSH Methanimidothioic acid   
488 C2H4O Ethylene oxide 1A1C2v
489 C2H4O+ ethylene oxide cation   
490 CH3CHO Acetaldehyde 1A'Cs
491 CH3CHO+ acetaldehyde cation   
492 H2COCH2+ Methyl, (methyleneoxoniumyl)-   
493 C2H4S Thiirane 1A1C2v
494 CH2CHSH Ethenethiol   
495 CH3CHS Thioacetaldehyde 1A'C1
496 NH2CHOH+ Formamide, O-protonated   
497 CH3SSH Hydrogen methyl disulfide   
498 HSCH2SH Methanedithiol   
499 C2H4OH+ ethylene oxide, protonated 1A'Cs
500 NH2CH2OH aminomethanol   
501 CH3CH2SH ethanethiol 1A'Cs
502 CH3CH2SH ethanethiol 1AC1
503 CH3SCH3 Dimethyl sulfide 1A1C2v
504 CH3SCH3+ dimethyl sulfide cation   
505 CNF iso cyanogen fluoride 1ΣC∞v
506 BrCN Cyanogen bromide 1ΣC∞v
507 FBO Boron monofluoride monoxide   
508 BeBr2 Beryllium bromide   
509 CaBr2 Calcium dibromide   
510 BF2 Boron difluoride radical 2A1C2v
511 FNO Nitrosyl fluoride 1A'Cs
512 ClNO Nitrosyl chloride 1A'Cs
513 FSN Thiazyl fluoride 1A'Cs
514 OPCl Phosphorus oxychloride   
515 CF2 Difluoromethylene 1A1D∞h
516 CFCl chlorofluoromethylene 1A'Cs
517 SiF2 Silicon difluoride 1A1C2v
518 GeCl2 Germanium dichloride 1A1C2v
519 CBr2 dibromomethylene 1A1C2v
520 CBr2 dibromomethylene 3B1C2v
521 FOO+ Fluorine dioxide cation   
522 OClO Chlorine dioxide 2B1D∞h
523 OClO- Chlorine dioxide anion 1A'Cs
524 BrOO Bromine dioxide   
525 PF2 Phosphorus difluoride   
526 PF2+ Phosphorus difluoride cation   
527 FClO chlorosyl fluoride 1A'Cs
528 ClOF Chlorine hypofluorite 1A'Cs
529 SF2 sulfur difluoride 1A1C2v
530 SeF2 Selenium difluoride   
531 SeCl2 Selenium Dichloride   
532 SBr2 Sulfur dibromide   
533 SeBr2 Selenium dibromide   
534 Br3- tribromide anion   
535 SFCl Sulfur chloride fluoride   
536 HCCF Fluoroacetylene 1ΣC∞v
537 HCCBr bromoacetylene 1ΣC∞v
538 CHF2 difluoromethyl radical 2ACs
539 CHF2+ difluoromethyl cation   
540 CHFCl Chlorofluoromethyl radical   
541 CHFCl+ Chlorofluoromethyl cation   
542 CHCl2+ dichloromethyl cation   
543 CHBr2 dibromomethyl radical   
544 NHF2 difluoramine   
545 NHCl2 dichloroamine   
546 CH2F2 Methane, difluoro- 1A1C2v
547 SiH2F2 difluorosilane   
548 CH2Cl2 Methylene chloride 1A1C2v
549 CH2BrCl Methane, bromochloro- 1A'Cs
550 CH2Br2 dibromomethane 1A1C2v
551 CH3MgBr Methyl Magnesium Bromide   
552 CH2CHF Ethene, fluoro- 1A'Cs
553 CH2FOH fluoromethanol   
554 CH2CH2Cl 2-chloroethyl radical 2A'Cs
555 CHClCH3 1-chloroethyl radical 2AC1
556 C2H5Br Ethyl bromide 1A'Cs
557 C4 Carbon tetramer 3ΣgD∞h
558 C4 Carbon tetramer   
559 C4H2+ diacetlyene cation 2ΠgD∞h
560 C4H4 Tetrahedrane   
561 CH2CHCH2CH3 1-Butene 1AC1
562 CH3CH2CH2CH3 Butane 1AgAnti
563 As4 Arsenic tetramer 1A1Td
564 HCCCN+ Cyanoacetylene cation 2ΠC∞v
565 H2CNCN cyanamide, methylene   
566 HNCCNH Ethenediimine   
567 C2H5CN ethyl cyanide 1A'Cs
568 H2NCHCHNH2 diaminoethylene   
569 CH7N3 triaminomethane   
570 NH2CH2CH2CH3 1-Propanamine 1A'Cs
571 N(SiH3)3 trisilylamine   
572 Na2O2 disodium dioxide   
573 K2O2 dipotassium dioxide   
574 ONNO NO dimer 1Agtrans C2H
575 ONNO NO dimer 1A1cis C2V
576 S2N2 Disulfur dinitride 1AGD2h
577 CS3-- Carbonotrithioate   
578 SO3 Sulfur trioxide 1A1'D3h
579 SO3-- Sulfate dianion   
580 S4 Sulfur tetramer   
581 S4 Sulfur tetramer   
582 S4 Sulfur tetramer   
583 HNO3 Nitric acid 1A'Cs
584 C3H2O Propadienal   
585 C3H2O Propadienal   
586 C2H2O2 Ethanedial 1AgC2h
587 CH3NCO methylisocyante   
588 HOCH2CN cyanomethanol   
589 CH3NO2 Methane, nitro- 1A'Cs
590 H3AlO3 Aluminum hydroxide   
591 CH2CHCHO Acrolein 1A'Cs
592 CH2CHCHO Acrolein   
593 CH2C(OH)NH2 1-amino vinyl alchohol   
594 CH3C(OH)=NH Ethaninidic acid   
595 CH3CSNH2 Ethanethioamide   
596 C3H6O Acetone enol 1A'Cs
597 CH3CH2CHO Propanal 1A'Cs
598 C3H7OH 1-Propanol   
599 Li2F2 Lithium fluoride dimer   
600 CF2O Carbonic difluoride 1A1C2v
601 CF2O+ Carbonic difluoride cation   
602 BF3 Borane, trifluoro- 1A'D3h
603 BF3+ boron trifluoride cation   
604 AlF3 Aluminum trifluoride 1A1'D3h
605 BClF2 Chlorodifluoroborane   
606 BCl3 Borane, trichloro- 1A1'D3h
607 BCl3+ Boron Trichloride cation   
608 GaF3 Gallium trifluoride 1A1'D3h
609 GaCl3 Gallium trichloride 1A1'D3h
610 CF2Cl difluorochloromethyl radical   
611 CFCl2 dichlorofluoromethyl radical   
612 CBr3 tribromomethyl radical   
613 ClO2F Chloryl fluoride 1A'Cs
614 SSCl2 Thiothionyl chloride   
615 NF3 Nitrogen trifluoride 1A1C3v
616 NCl3 nitrogen trichloride 1A1C3v
617 NBr3 Nitrogen Tribromide 1A1C3v
618 HClO3 Chloric Acid 1A'Cs
619 HClO3 Chloric Acid 1AC1
620 CHF3 Methane, trifluoro- 1A1C3v
621 SiHF3 trifluorosilane   
622 CHBrF2 Methane, bromodifluoro- 1A'Cs
623 CHBrCl2 Methane, bromodichloro- 1A'Cs
624 CHBr2F dibromofluoromethane   
625 AsF3H+ Arsenic trifluoride, protonated   
626 C2H2ClF 1-chloro-1-fluoroethylene 1A'Cs
627 CHFCHCl (E)-1-chloro-2-fluoroethene 1A'Cs
628 CHFCHClz (Z)-1-Chloro-2-fluoroethene 1A'Cs
629 CHBrCHBr Ethene, 1,2-dibromo-, (E)-   
630 CHBrCHBr Ethene, 1,2-dibromo-, (Z)-   
631 C2H4F2 1,2-difluoroethane 1AgC2H anti
632 C2H4F2 1,2-difluoroethane 1AC2 gauche
633 CH3CHF2 Ethane, 1,1-difluoro- 1A'Cs
634 CH2BrCH2Cl 1-bromo-2-chloroethane   
635 CH2BrCH2Br Ethane, 1,2-dibromo- 1AgC2h
636 CH2BrCH2Br Ethane, 1,2-dibromo- 1AC2
637 CH2CHCH2F Allyl Fluoride   
638 CH2CHCH2F Allyl Fluoride   
639 CH3CHCHF trans-1-Fluoro-1-propene   
640 CH2FCH2OH 2-fluoroethanol   
641 CH2FCH2CH3 1-Fluoropropane 1A'Cs
642 CH2FCH2CH3 1-Fluoropropane   
643 CH3CHFCH3 2-Fluoropropane 1A'Cs
644 B5H9 pentaborane9   
645 C5H4 pentatetraene   
646 C5H6 Propellane 1A1D3h
647 C5H8 Bicyclo[1.1.1]pentane   
648 C3H4N2 2H-Imidazole 1A1C2v
649 C4H5N Pyrrole 1A1C2v
650 C3O2 Carbon suboxide 1ΣGD∞h
651 B2O3 diboron trioxide   
652 B2O3 diboron trioxide   
653 CHOOCHO diformyl ether   
654 C3H3NS Thiazole   
655 CH3COCCH 3-butyn-2-one 1A'Cs
656 C4H4Se selenophene   
657 HCOOC2H5 Ethyl formate 1A'Cs
658 C2H6O2S Dimethyl sulfone 1A1C2v
659 C4H8S Thiophene, tetrahydro- 1AC1
660 C4H10O Methyl propyl ether 1AC1
661 C(CH3)3SH 2-Propanethiol, 2-methyl- 1A'Cs
662 C4H9SH 1-Butanethiol   
663 CF3Cl Methane, chlorotrifluoro- 1A1C3v
664 CF2Cl2 difluorodichloromethane 1A1C2v
665 CF3Br Bromotrifluoromethane 1A1C3v
666 CBrCl2F bromodichlorofluoromethane   
667 CBr2ClF dibromochlorofluoromethane   
668 CBr2Cl2 dibromodichloromethane 1A1C2v
669 CBr3Cl tribromochloromethane 1A1C3v
670 GeBr4 Germanium tetrabromide   
671 SF4 Sulfur tetrafluoride 1A1C2v
672 SeF4 Selenium tetrafluoride   
673 SCl4 Sulfur tetrachloride   
674 CH2ClCCCl 1,3-dichloropropyne   
675 CHCl2CCH 3,3-dichloropropyne   
676 CHCl2CHO dichloroacetaldehyde   
677 CHF2CH2F Ethane, 1,1,2-trifluoro 1AC1
678 CH2CClCHCH2 1,3-Butadiene, 2-chloro-   
679 CH2FCH2CH2F 1,3-difluoropropane   
680 C2H2N2O Furazan   
681 C6H6 Prismane   
682 C6H6 1,2,4,5-Hexatetraene 1AgC2h
683 C6H6 Benzvalene 1A1C2v
684 C6H6 Dewar Benzene   
685 N3P3 1,3,5,2,4,6-Triazatriphosphorine   
686 N2O4 Dinitrogen tetroxide 1AgD2d
687 C3H2O3 vinylene carbonate   
688 C5H6O 2H-Pyran   
689 C5H6O Pentadienal   
690 C4H6O2 γ–Butyrolactone 1AC1
691 C3H6O3 1,3,5-Trioxane 1A1C1
692 C5H10O 3-Pentanone 1A1C2v
693 C4F2 difluorobutadiyne   
694 C2ClF3 Ethene, chlorotrifluoro-   
695 C2Br4 tetrabromoethene   
696 SiF5- silicon pentafluoride anion   
697 CHCl2CHCl2 Ethane, 1,1,2,2-tetrachloro-   
698 C7H7 cycloheptatrienyl radical 2A2C2v
699 C7H7+ cycloheptatrienyl cation 1A1'D7h
700 CH(CN)3 tricyanomethane   
701 F2CCCF2 tetrafluoroallene   
702 SF6 Sulfur Hexafluoride 1A1GOh
703 S4N4 Tetrasulfur tetranitride   
704 C6H5CHO benzaldehyde 1A'Cs
705 C6H4Cl2 1,4-dichlorobenzene   
706 C6H5NO nitrosobenzene 1A'Cs
707 C3F6 hexafluoropropene   
708 C8H18O 1-Octanol   
709 B12H12-- Dodecahydrododecaborate(2-)   

Species NOT done yet
count Species Name file name problem
1 D Deuterium atom d  
2 D- Deuterium atom anion d-  
3 D+ Deuterium atom cation d+  
4 H- Hydrogen atom anion h-  
5 H2- hydrogen diatomic anion h2-  
6 H2+ Hydrogen cation h2+  
7 H3+ hydrogen trimer cation h3+  
8 He- Helium atom anion he-  
9 HeH Helium hydride heh  
10 Li- Lithium atom anion li-  
11 Li+ Lithium atom cation li+  
12 Na- Sodium atom anion na-  
13 Na+ Sodium atom cation na+  
14 K- Potassium atom anion k-  
15 K+ Potassium atom cation k+  
16 Cu- Copper atom anion cu-  
17 Cu+ Copper atom cation cu+  
18 LiH- lithium hydride anion lih-  
19 LiH+ lithium hydride cation lih+  
20 NaH- sodium hydride anion nah-  
21 NaH+ sodium hydride cation nah+  
22 KH+ Potassium hydrogen cation kh+  
23 Be- Beryllium atom anion be-  
24 Mg- Magnesium atom anion mg-  
25 Ca Calcium atom ca  
26 Ca- Calcium atom anion ca-  
27 Ca+ Calcium atom cation ca+  
28 Zn- Zinc atom anion zn-  
29 Zn+ Zinc atom cation zn+  
30 BeH- berylium monohydride anion beh-  
31 BeH+ beryllium monohydride cation beh+  
32 MgH- magnesium monohydride anion mgh-  
33 MgH+ magnesium monohydride cation mgh+  
34 CaH Calcium monohydride cah  
35 CaH+ Calcium monohydride cation cah+  
36 TiH Titanium monohydride tih  
37 ZnH Zinc monohydride znh  
38 BeH2 beryllium dihydride beh2  
39 MgH2 magnesium dihydride mgh2  
40 ZnH2 Zinc hydride znh2  
41 B- Boron atom anion b-  
42 Sc Scandium atom sc  
43 Sc+ Scandium cation sc+  
44 BH- boron monohydride anion bh-  
45 BH+ boron monohydride cation bh+  
46 AlH aluminum monohydride alh  
47 AlH- aluminum monohydride anion alh-  
48 AlH+ aluminum monohydride cation alh+  
49 ScH Scandium monohydride sch  
50 ScH+ Scandium monohydride cation sch+  
51 BH2 boron dihydride bh2  
52 BH2- boron dihydride anion bh2-  
53 BH2+ Boron dihydride cation bh2+  
54 AlH2 aluminum dihydride alh2  
55 AlH2- aluminum dihydride anion alh2-  
56 AlH2+ aluminum dihydride cation alh2+  
57 BH3 boron trihydride bh3  
58 BH3- boron trihydride anion bh3-  
59 AlH3 aluminum trihydride alh3  
60 AlH3+ aluminum trihydride cation alh3+  
61 ScH3 Scandium trihydride sch3  
62 GaH3 Gallium trihydride gah3  
63 BH4 borohydride bh4  
64 AlH4- Aluminum tetrahydride anion alh4-  
65 C- Carbon atom anion c-  
66 Ti Titanium atom ti  
67 Ti- Titanium atom anion ti-  
68 Ti+ Titanium atom cation ti+  
69 Sn Tin atom sn  
70 Sn+ Tin cation sn+  
71 CH- methylidyne anion ch-  
72 CH+ Methylidyne cation ch+  
73 SiH- silicon monohydride anion sih-  
74 SiH+ silicon monohydride cation sih+  
75 GeH+ Germaniun monohyrdide cation geh+  
76 CH2 Methylene ch2  
77 CH2+ methylene cation ch2+  
78 SiH2 silicon dihydride sih2  
79 SiH2- silicon dihydride anion sih2-  
80 SiH2+ silicon dihydride cation sih2+  
81 GeH2- germylene anion geh2-  
82 CH3 Methyl radical ch3  
83 CH3- methyl anion ch3-  
84 CH3+ methyl cation ch3+  
85 SiH3- Silyl anion sih3-  
86 CD4 methane-d4 cd4  
87 CH2D2 methane-d2 ch2d2  
88 CH3D methane-d ch3d  
89 CH4- Methane anion ch4-  
90 CH4+ Methane cation ch4+  
91 CHD3 methane-d3 chd3  
92 SiH4 Silane sih4  
93 SiH4+ Silane cation sih4+  
94 SnH4 Stannane snh4  
95 N- Nitrogen atom anion n-  
96 P- Phosphorus atom anion p-  
97 P+ Phosphorus atom cation p+  
98 V Vanadium atom v  
99 Sb Antimony atom sb  
100 NH- Imidogen anion nh-  
101 NH+ imidogen cation nh+  
102 PH- phosphorus monohydride anion ph-  
103 PH+ phosphorus monohydride cation ph+  
104 AsH+ Arsenic monohydride cation ash+  
105 SbH Antimony monohydride sbh  
106 ND2 Amidogen-d2 nd2  
107 NH2- amino anion nh2-  
108 PH2 Phosphino radical ph2  
109 PH2- Phosphino anion ph2-  
110 PH2+ Phosphino cation ph2+  
111 AsH2 Arsenic dihydride ash2  
112 AsH2+ Arsenic dihydride cation ash2+  
113 ND3 Ammonia-d3 nd3  
114 NH3- Ammonia anion nh3-  
115 NH3+ ammonia cation nh3+  
116 AsH3 Arsine ash3  
117 SbH3 Stibine sbh3  
118 NH4+ ammonium cation nh4+  
119 PH4+ phosphonium cation ph4+  
120 O- Oxygen atom anion o-  
121 S- Sulfur atom anion s-  
122 S+ Sulfur atom cation s+  
123 Cr Chromium atom cr  
124 Te Tellurium atom te  
125 Te+ Tellurium atom cation te+  
126 OH- hydroxide anion oh-  
127 TeH Telluryl radical teh  
128 D2O Deuterium oxide d2o  
129 D2S Hydrogen sulfide-d2 d2s  
130 H2S Hydrogen sulfide h2s  
131 H2S- Hydrogen sulfide anion h2s-  
132 H2Te Hydrogen Telluride h2te  
133 H3O+ hydronium cation h3o+  
134 F- Fluorine atom anion f-  
135 Cl- Chlorine atom anion cl-  
136 Mn Manganese atom mn  
137 I Iodine atom iodine  
138 I- Iodine atom anion iodine-  
139 I+ Iodine atom cation iodine+  
140 HI Hydrogen iodide hi  
141 HI+ Hydrogen iodide cation hi+  
142 H2F+ dihydrogen fluoride cation h2f+  
143 H2I+ Iodonium h2i+  
144 Ne- Neon atom anion ne-  
145 Ar- Argon atom anion ar-  
146 Ar+ Argon atom cation ar+  
147 Fe Iron atom fe  
148 Xe Xenon atom xe  
149 NeH neon hydrogen neh  
150 NeH+ neon hydrogen cation neh+  
151 XeH+ Xenon, protonated xeh+  
152 H2Ar H2 Ar dimer h2ar  
153 Co Cobalt atom cobalt  
154 Ni Nickel atom ni  
155 Li2- lithium diatomic anion li2-  
156 Li2+ lithium diatomic cation li2+  
157 NaLi- lithium sodium anion lina-  
158 NaLi+ lithium sodium cation lina+  
159 LiK Lithium Potassium lik  
160 Na2+ sodium diatomic cation na2+  
161 NaK Sodium Potassium nak  
162 NaK+ Sodium Potassium diatomic cation nak+  
163 K2 Potassium diatomic k2  
164 Cu2 Copper diatomic cu2  
165 LiBe Lithium Beryllium libe  
166 LiMg Lithium magnesium limg  
167 NaBe Sodium Beryllium nabe  
168 NaMg Sodium Magnesium namg  
169 Be2 Beryllium diatomic be2  
170 Be2- Beryllium diatomic anion be2-  
171 Be2+ Beryllium diatomic cation be2+  
172 BeMg Beryllium Magnesium bemg  
173 Mg2- magnesium diatomic anion mg2-  
174 Mg2+ magnesium diatomic cation mg2+  
175 Ca2 Calcium diatomic ca2  
176 LiB Lithium boride lib  
177 NaAl Sodium aluminum naal  
178 BeB Beryllium monoboride beb  
179 B2- Boron diatomic anion b2-  
180 B2+ Boron diatomic cation b2+  
181 BAl Boron Aluminum bal  
182 Al2- aluminum diatomic anion al2-  
183 Al2+ aluminum diatomic cation al2+  
184 BGa Boron Gallium bga  
185 AlGa Aluminum Gallium alga  
186 Ga2 Gallium diatomic ga2  
187 LiBH4 Lithium borohydride libh4  
188 HBHHBH Diborane(4) C2V hbhhbh  
189 Al2H6 dialane al2h6  
190 Ga2H6 digallane ga2h6  
191 LiC Lithium Carbide lic  
192 BeC Beryllium Carbide bec  
193 BC boron monocarbide bc  
194 BC- boron monocarbide anion bc-  
195 BC+ boron monocarbide cation bc+  
196 AlC Aluminum carbide alc  
197 C2- carbon diatomic anion c2-  
198 C2+ carbon diatomic cation c2+  
199 SiC silicon monocarbide sic  
200 SiC- silicon monocarbide anion sic-  
201 SiC+ silicon monocarbide cation sic+  
202 Si2- silcon diatomic anion si2-  
203 Si2+ silcon diatomic cation si2+  
204 Ge2 Germanium diatomic ge2  
205 C2H Ethynyl radical c2h  
206 C2H+ Ethynyl cation c2h+  
207 ZnCH2 Zinc methylene znch2  
208 CCH2 vinylidene vinylidene  
209 CuCH3 monomethyl copper cuch3  
210 ZnCH3 Zinc monomethyl znch3  
211 CH2BH methyleneborane ch2bh  
212 C2H3- vinyl anion c2h3-  
213 C2H4- Ethylene anion c2h4-  
214 CH3CH methylmethylene ch3ch  
215 CH2SiH2 silaethylene ch2sih2  
216 CH3BH2 methylborane ch3bh2  
217 C2H5- Ethyl anion c2h5-  
218 C2H5+ Ethyl cation c2h5+  
219 C2H6+ ethane cation c2h6+  
220 CH3SiH3 methyl silane ch3sih3  
221 GeH3CH3 methyl germane geh3ch3  
222 C2H7+ Ethane, protonated c2h7+  
223 LiN+ Lithium Nitride cation lin+  
224 BeN Beryllium mononitride ben  
225 BeN- Beryllium mononitride anion ben-  
226 BeN+ Beryllium mononitride cation ben+  
227 BN- boron nitride anion bn-  
228 AlN- aluminum mononitride anion aln-  
229 AlN+ aluminum mononitride cation aln+  
230 BP Boron monophosphide bp  
231 AlP Aluminum monophosphide alp  
232 GaN Gallium mononitride gan  
233 GaP Gallium monophosphide gap  
234 BN+ boron nitride cation bn+  
235 AlN Aluminum nitride aln  
236 CN- cyanide anion cn-  
237 CN+ Cyano cation cn+  
238 CP- carbon monophosphide anion cp-  
239 CP+ carbon monophosphide cation cp+  
240 SiN- silicon mononitride anion sin-  
241 SiN+ silicon mononitride cation sin+  
242 SiP- Silicon monophosphide anion sip-  
243 SiP+ Silicon monophosphide cation sip+  
244 TiN Titanium mononitride tin  
245 N2- nitrogen diatomic anion n2-  
246 N2+ diatomic nitrogen cation n2+  
247 PN- phosphorus nitride anion pn-  
248 PN+ phosphorus nitride cation pn+  
249 P2- phosphorus diatomic anion p2-  
250 P2+ phosphorus diatomic cation p2+  
251 AsN Arsenic mononitride asn  
252 AsP Arsenic monophosphide asp  
253 SbN Antimony nitride sbn  
254 As2 Arsenic diatomic as2  
255 HNB hydrogen nitrogen boron hnb  
256 HNC hydrogen isocyanide hnc  
257 HCN- Hydrogen cyanide anion hcn-  
258 HCP Phosphaethyne hcp  
259 NNH Dinitrogen monohydride nnh  
260 HPO Hydrogen phosphorus oxide hpo  
261 HPO+ Hydrogen phosphorus oxide cation hpo+  
262 CNH2 Aminomethylidyne radical cnh2  
263 CNH2+ N-protonated hydrogen isocyanide cnh2+  
264 H2CN Dihydrogen cyanide radical h2cn  
265 H2CN+ hydrocyanonium cation h2cn+  
266 HCNH methyleneazane hcnh  
267 HCNH+ N-protonated HCN hcnh+  
268 N2H2 (E)-diazene n2h2  
269 N2H2 (Z)-Diazene n2h2z  
270 CH2PH Phosphaethene ch3p  
271 CH2NH2+ methyleneamine cation ch2nh2+  
272 N2H4+ hydrazine cation n2h4+  
273 P2H4 Diphosphine p2h4  
274 CH3NH2+ methyl amine cation ch3nh2+  
275 CH3PH2 Methyl phosphine ch3ph2  
276 N2H5+ protonated hydrazine n2h5+  
277 BH3NH3 borane ammonia bh3nh3  
278 CH3NH3+ protonated methylamine ch3nh3+  
279 CH3PH3+ methyl phosphine, protonated ch3ph3+  
280 NH3NH3 Ammonia Dimer nh3nh3  
281 LiO- lithium oxide anion lio-  
282 LiO+ lithium oxide cation lio+  
283 LiS Lithium monosulfide lis  
284 LiS+ Lithium sulfide cation lis+  
285 NaO- sodium oxide anion nao-  
286 NaO+ sodium oxide cation nao+  
287 KO Potassium monoxide ko  
288 KO+ Potassium monoxide cation ko+  
289 NaS Sodium sulfide nas  
290 CuO Copper Monoxide cuo  
291 BeO- Beryllium monoxide anion beo-  
292 BeO+ Beryllium monoxide cation beo+  
293 MgO- magnesium oxide anion mgo-  
294 MgO+ magnesium oxide cation mgo+  
295 MgS- magnesium sulfide anion mgs-  
296 MgS+ magnesium sulfide cation mgs+  
297 ZnO zinc monoxide zno  
298 ZnS Zinc sulfide zns  
299 BeS- Beryllium monosulfide anion bes-  
300 BeS+ Beryllium monosulfide cation bes+  
301 BO- boron monoxide anion bo-  
302 AlO Aluminum monoxide alo  
303 AlO- Aluminum monoxide anion alo-  
304 AlO+ aluminum monoxide cation alo+  
305 BS- boron monosulfide anion bs-  
306 BS+ boron monosulfide cation bs+  
307 AlS- aluminum monosulfide anion als-  
308 AlS+ aluminum monosulfide cation als+  
309 ScO Scandium monoxide sco  
310 BO+ boron monoxide cation bo+  
311 CS- carbon monosulfide anion cs-  
312 CS+ carbon monosulfide cation cs+  
313 SiO- silicon monoxide anion sio-  
314 SiO+ silicon monoxide cation sio+  
315 SiS- silicon monosulfide anion sis-  
316 SiS+ silicon monosulfide cation sis+  
317 TiO Titanium monoxide tio  
318 CSe- Carbon monoselenide anion cse-  
319 CSe+ Carbon monoselenide cation cse+  
320 GeO+ Germanium monoxide cation geo+  
321 GeS Germanium monosulfide ges  
322 NS- nitrogen sulfide anion ns-  
323 NS+ nitrogen sulfide cation ns+  
324 PO- phosphorus monoxide anion po-  
325 PO+ phosphorus monoxide cation po+  
326 PS- phosphorus monosulfide anion ps-  
327 PS+ phosphorus monosulfide cation ps+  
328 VO Vanadium monoxide vo  
329 AsO Arsenic monoxide aso  
330 O2- oxygen diatomic anion o2-  
331 O2+ diatomic oxygen cation o2+  
332 SO- sulfur monoxide anion so-  
333 S2- sulfur diatomic anion s2-  
334 S2+ sulfur diatomic cation s2+  
335 SeO- selenium monoxide anion seo-  
336 SeO+ selenium monoxide cation seo+  
337 SeS Selenium monosulfide ses  
338 SeS- selenium monosulfide anion ses-  
339 SeS+ selenium monosulfide cation ses+  
340 TeO Tellurium monoxide teo  
341 Se2- selenium diatomic anion se2-  
342 Se2+ selenium diatomic cation se2+  
343 Te2 Tellurium diatomic te2  
344 NaOH sodium hydroxide naoh  
345 MgOH magnesium hydroxide mgoh  
346 CaOH Calcium monohydroxide caoh  
347 COH+ Carbon Monoxide, protonated coh+  
348 HCS Thioformyl radical hcs  
349 HCS- Thioformyl anion hcs-  
350 HCS+ Thioformyl cation hcs+  
351 HNO- Nitrosyl hydride anion hno-  
352 NOH Hydroxyimidogen noh  
353 NOH+ O-protonated nitric oxide noh+  
354 HNS Sulfur imide hns  
355 HNS- Sulfur imide anion hns-  
356 HO2 Hydroperoxy radical ho2  
357 HO2- Hydroperoxy anion ho2-  
358 HO2+ Hydroperoxy cation ho2+  
359 HS2 Thiosulfeno radical hs2  
360 HOCH hydroxycarbene hoch  
361 H2CS+ thioformaldehyde cation h2cs+  
362 H2NO nitroxide h2no  
363 H2O2+ Hydrogen peroxide cation h2o2+  
364 H2S2 Disulfane h2s2  
365 H2S2+ hydrogen disulfide cation h2s2+  
366 CH2OH Hydroxymethyl radical ch2oh  
367 CH3O Methoxy radical ch3o  
368 CH3O+ Methoxy cation ch3o+  
369 CH3S thiomethoxy ch3s  
370 H2CSH+ Thioformaldehyde, protonated h2csh+  
371 NH3O Ammonia Oxide nh3o  
372 H2POH Phosphinous acid h2poh  
373 H3PO Phosphine oxide h3po  
374 H3O2+ hydrogen peroxide, protonated h3o2+  
375 CH3OH- Methyl alcohol anion ch3oh-  
376 CH3SH Methanethiol ch3sh  
377 CH3SH+ Methanethiol cation ch3sh+  
378 CH3SeH Methane selenol ch3seh  
379 H2OH2O water dimer h2oh2o  
380 CH3OH2+ Methanol, protonated ch3oh2+  
381 CH3SH2+ protonated methylsulfide ch3sh2+  
382 H2ONH3 Water Ammonia Dimer h2onh3  
383 LiCl- lithium chloride anion licl-  
384 LiCl+ lithium chloride cation licl+  
385 NaF- sodium fluoride anion naf-  
386 KF Potassium Fluoride kf  
387 NaCl- sodium chloride anion nacl-  
388 NaCl+ sodium chloride cation nacl+  
389 KCl Potassium Chloride kcl  
390 LiBr- lithium bromide anion libr-  
391 LiBr+ lithium bromide cation libr+  
392 CuCl Copper monochloride cucl  
393 NaBr- sodium bromide anion nabr-  
394 NaBr+ sodium bromide cation nabr+  
395 KBr Potassium Bromide kbr  
396 LiI Lithium Iodide lii  
397 NaI Sodium Iodide nai  
398 KI Potassium Iodide ki  
399 LiF- lithium fluoride anion lif-  
400 BeF- Beryllium monofluoride anion bef-  
401 BeF+ Beryllium monofluoride cation bef+  
402 MgF- magnesium fluoride anion mgf-  
403 MgF+ magnesium fluoride cation mgf+  
404 CaF Calcium monofluoride caf  
405 MgCl- magnesium monochloride anion mgcl-  
406 MgCl+ magnesium monochloride cation mgcl+  
407 CaCl calcium monochloride cacl  
408 TiCl Titanium Monochloride ticl  
409 ZnF Zinc monofluoride znf  
410 ZnF- Zinc monofluoride anion znf-  
411 ZnF+ Zinc monofluoride cation znf+  
412 ZnCl Zinc monochloride zncl  
413 BeCl- beryllium monochloride anion becl-  
414 BeCl+ beryllium monochloride cation becl+  
415 BF- Boron monofluoride anion bf-  
416 BF+ Boron monofluoride cation bf+  
417 AlF- Aluminum monofluoride anion alf-  
418 AlF+ Aluminum monofluoride cation alf+  
419 BCl- boron monochloride anion bcl-  
420 BCl+ boron monochloride cation bcl+  
421 AlCl Aluminum monochloride alcl  
422 AlCl- aluminum monochloride anion alcl-  
423 AlCl+ aluminum monochloride cation alcl+  
424 ScF Scandium monofluoride scf  
425 BBr Boron monobromide bbr  
426 GaF+ Gallium monofluoride cation gaf+  
427 GaCl+ Gallium monochloride cation gacl+  
428 AlI Aluminum monoiodide ali  
429 CF- carbon monofluoride anion cf-  
430 CF+ carbon monofluoride cation cf+  
431 CCl- carbon monochloride anion ccl-  
432 CCl+ carbon monochloride cation ccl+  
433 SiF- silicon monofluoride anion sif-  
434 SiF+ silicon monofluoride cation sif+  
435 SiCl- silicon monochloride anion sicl-  
436 SiCl+ silicon monochloride cation sicl+  
437 GeF+ Germanium monofluoride cation gef+  
438 NF- nitrogen monofluorine anion nf-  
439 NF+ nitrogen monofluoirde cation nf+  
440 NCl- nitrogen monochloride anion ncl-  
441 NCl+ nitrogen monochloride cation ncl+  
442 PF- phosphorus monofluoride anion pf-  
443 PF+ phosphorus monofluoride cation pf+  
444 PCl- phosphorus monochloride anion pcl-  
445 PCl+ phosphorus monochloride cation pcl+  
446 AsF Arsenic monofluoride asf  
447 NBr nitrogen monobromide nbr  
448 AsCl Arsenic monochloride ascl  
449 SbF Antimony monofluoride sbf  
450 SbCl Antimony monochloride sbcl  
451 FO- flourine oxide anion fo-  
452 FO+ fluorine monoxide cation fo+  
453 ClO- chlorine monoxide anion clo-  
454 SF- sulfur monofluoride anion sf-  
455 SCl- sulfur monochloride anion scl-  
456 BrO- Bromine monoxide anion bro-  
457 SeF Selenium monofluoride sef  
458 SeCl Selenium monochloride secl  
459 IO Iodine monoxide io  
460 F2- flourine diatomic anion f2-  
461 ClF- clorine monofluoride anion clf-  
462 Cl2- chlorine diatomic anion cl2-  
463 BrF- bromine fluoride anion brf-  
464 BrF+ bromine fluoride cation brf+  
465 BrCl- bromine chloride anion brcl-  
466 BrCl+ bromine chloride cation brcl+  
467 IF Iodine monofluoride if  
468 ICl Iodine monochloride icl  
469 IBr Iodine monobromide ibr  
470 I2 Iodine diatomic i2  
471 I2+ Iodine diatomic cation i2+  
472 HCCl Chloromethylene hccl  
473 CHBr bromomethylene chbr  
474 DOCl Hypochlorous acid-d docl  
475 HOBr Hypobromous acid hobr  
476 HOBr+ Hypobromous acid cation hobr+  
477 HOI Hypoiodous acid hoi  
478 FHF Hydrogen difluoride fhf  
479 FHF- Hydrogen difluoride anion fhf-  
480 NH2F monofluoroamine nh2f  
481 H2F2 Hydrogen fluoride dimer h2f2  
482 CD3F methylfluoride-d3 cd3f  
483 CH3F Methyl fluoride ch3f  
484 CD3Cl methyl chloride d3 cd3cl  
485 SiH3Br bromosilane sih3br  
486 CH3I methyl iodide ch3i  
487 SiH3I Silyl Iodide sih3i  
488 Ne2 Neon diatomic ne2  
489 Ne2+ Neon diatomic cation ne2+  
490 Ar2+ Argon diatomic cation ar2+  
491 Li3 Lithium trimer li3  
492 Li3+ Lithium trimer cation li3+  
493 C3+ carbon trimer cation c3+  
494 C3H3 cyclopropenyl radical cpr  
495 C3H3 Propargyl radical propargyl  
496 C3H3- Propargyl anion c3h3-  
497 C3H3+ cyclopropenyl cation cpr+  
498 C3H3+ Propargyl cation c3h3+  
499 C3H5+ Allyl cation allyl+  
500 CH3CHCH 1-propenyl radical ch3chch  
501 Zn(CH3)2 dimethyl zinc dmz  
502 C3H7+ cyclopropane, protonated c3h7+  
503 SiH2(CH3)2 dimethylsilane dms  
504 NaCN Sodium Cyanide nacn  
505 CuCN Copper cyanide cucn  
506 CN2 3H-Diazirin-3-ylidene cn2  
507 NCN Cyanoimidogen ncn  
508 N3- azide anion n3-  
509 N3+ azide cation n3+  
510 HCCN cyanomethylene hccn  
511 HCNN diazomethyl radical hcnn  
512 CH2N2 diazirine ch2n2  
513 CH2NN diazomethane ch2nn  
514 NH2CN cyanamide cyanamide  
515 CH3CN+ Acetonitrile cation ch3cn+  
516 CH3NC methyl isocyanide ch3nc  
517 HNCNH2+ diiminomethane, protonated hncnh2+  
518 NCNH3+ Cyanamide, protonated ncnh3+  
519 CH2CHNH vinylazine ch2chnh  
520 CH3CHN methylmethaniminyl radical ch3chn  
521 NHCHNH2 aminomethanimine cn2h4  
522 C2H5N Aziridine c2h5n  
523 CH2CHNH2 aminoethene aminoethene  
524 CH2NCH3 N-methylmethanimine nmm  
525 CH3CHNH ethanimine ethanimine  
526 NH2BHNH2 diaminoborane nh2bhnh2  
527 C2H5NH+ Protonated Aziridine c2h5nh+  
528 NH2CH2NH2 diaminomethane nh2ch2nh2  
529 CH3NHCH3 Dimethylamine ch3nhch3  
530 CH3PHCH3 dimethylphosphine ch3phch3  
531 NH2CH2NH3+ diaminoethane, protonated pdam  
532 (CH3)2NH2+ dimethylammonium cation dmam  
533 CH3CH2NH3+ ethylamine, protonated pea  
534 Li2O+ dilithium oxide cation li2o+  
535 Li2S dilithium sulfide li2s  
536 CCO Dicarbon monoxide cco  
537 CNO- fulminate cno-  
538 NCO- cyanate nco-  
539 SCN thiocyanato radical scn  
540 SCN- thiocyanide anion scn-  
541 BO2 Boron dioxide bo2  
542 BO2- Boron dioxide anion bo2-  
543 BO2+ Boron dioxide cation bo2+  
544 N2O- Nitrous oxide anion n2o-  
545 N2O+ Nitrous oxide cation n2o+  
546 NNS Nitrogen sulfide nns  
547 PPO Phosphorus oxide phosphide ppo  
548 CO2- Carbon dioxide anion co2-  
549 CO2+ Carbon dioxide cation co2+  
550 OCS+ Carbonyl sulfide cation cos+  
551 SiO2 silicon dioxide sio2  
552 CS2- Carbon disulfide anion cs2-  
553 CS2+ Carbon disulfide cation cs2+  
554 SiS2 Silicon disulfide sis2  
555 GeS2 Germanium disulfide ges2  
556 CSe2 Carbon diselenide cse2  
557 SCTe Carbon sulfide Telluride scte  
558 NO2 Nitrogen dioxide no2  
559 NO2- Nitrogen dioxide anion no2-  
560 NO2+ Nitrogen dioxide cation no2+  
561 PO2 Phosphorus dioxide po2  
562 PO2- Phosphorus dioxide anion po2-  
563 PO2+ Phosphorus dioxide cation po2+  
564 AsO2 Aresenic dioxide aso2  
565 O3- Ozone anion o3-  
566 O3+ Ozone cation o3+  
567 SO2- Sulfur dioxide anion so2-  
568 SO2+ Sulfur dioxide cation so2+  
569 S3- Sulfur trimer anion s3-  
570 S3+ Sulfur trimer cation s3+  
571 SeO2+ Selenium dioxide cation seo2+  
572 TeO2 Tellurium Dioxide teo2  
573 CS2H+ Carbon disulfide, protonated cs2h+  
574 HNCO Isocyanic acid hnco  
575 HOCN cyanic acid hocn  
576 HCO2- formate anion hco2-  
577 HNNO nitrosoazane hnno  
578 HNNO+ Nitrous oxide, N-protonated hnno+  
579 NNOH+ Nitrous Oxide, O-protonated nnoh+  
580 HCOO formate neutral radical hcoo  
581 HOCO+ Hydrocarboxyl cation hoco+  
582 HNO2 Nitrous acid hno2  
583 HNO2+ nitrous acid cation hno2+  
584 SO2H+ protonated sulfur dioxide so2h+  
585 CH2CO+ Ketene cation ch2co+  
586 HCCOH ethynol hccoh  
587 Mg(OH)2 Magnesium dihydroxide h2mgo2  
588 NH2NO Nitrosamide nh2no  
589 CH2O2 Dioxirane diox  
590 H2O3 Hydrogen trioxide h2o3  
591 HSSSH trisulfane hsssh  
592 NaOCH3 Sodium methoxide naoch3  
593 CH2BOH hydroxy(methylene)borane ch2boh  
594 CH3BO Borane, methyloxo- ch3bo  
595 CH2CHO Vinyloxy radical ch2cho  
596 CH3CO Acetyl radical ch3co  
597 CH3CO- Acetyl anion ch3co-  
598 CH3CO+ acetyl cation ch3co+  
599 CH2NOH formaldoxime ch2noh  
600 CH3NO nitrosomethane ch3no  
601 CHONH2 formamide formamide  
602 CNOH3 1,2-oxaziridine cnoh3  
603 CH2OOH CH2OOH radical ch2ooh  
604 CH3OO methylperoxy radical ch3oo  
605 CH3OO- methylperoxy anion ch3oo-  
606 CH3OO+ methylperoxy cation ch3oo+  
607 CH2CHOH ethenol ch2choh  
608 H2CONH2+ protonated formamide h2conh2+  
609 NH3CHO+ Formamide, N-Protonated nh3cho+  
610 CH2(OH)2 methanediol ch2o2h2  
611 CH3OOH Methyl peroxide ch3ooh  
612 H2OH2CO water formaldehyde dimer h2oh2co  
613 CH2CH2OH 2-hydroxy ethyl radical ch2ch2oh  
614 CH3CH2O Ethoxy radical ethoxy  
615 CH3CHOH 1-hydroxy-ethyl radical ch3choh  
616 CH3CHOH+ acetaldehyde, protonated ch3choh+  
617 CH3OCH2 methoxymethyl radical ch3och2  
618 CH3CH2OH Ethanol etoh  
619 CH3OCH3 Dimethyl ether meome  
620 CH3SeCH3 dimethylselenide dmse  
621 CH3OHH2O methanol water dimer ch3ohh2o  
622 H2OCH3OH water methanol dimer h2och3oh  
623 CuF2 Copper difluoride cuf2  
624 ZnF2 Zinc difluoride znf2  
625 FCN Cyanogen fluoride fcn  
626 ClCN chlorocyanogen clcn  
627 ICN Cyanogen iodide icn  
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 CaF2 Calcium difluoride caf2  
635 FCO Carbonyl fluoride fco  
636 FCO+ Carbonyl fluoride cation fco+  
637 ClCO carbonyl monochloride clco  
638 FNS Thionitrosyl fluoride fns  
639 BrNO Nitrosyl bromide brno  
640 INO Nitrosyl iodide ino  
641 CF2- Difluoromethylene anion cf2-  
642 CF2+ Difluoromethylene cation cf2+  
643 SiF2+ Silicon difluoride cation sif2+  
644 CCl2 dichloromethylene ccl2  
645 CCl2- dichloromethylene anion ccl2-  
646 CCl2+ dichloromethylene cation ccl2+  
647 SiCl2 Dichlorosilylene sicl2  
648 GeF2 Germanium difluoride gef2  
649 FOO Dioxygen monofluoride radical foo  
650 ClOO chloroperoxy radical cloo  
651 ClOO+ chloroperoxy cation cloo+  
652 OClO+ Chlorine dioxide cation oclo+  
653 ClSO Sulfur chloride oxide clso  
654 ClS2 Sulfur chloride cls2  
655 OBrO Bromine dioxide radical obro  
656 NF2 Difluoroamino radical nf2  
657 NF2+ Difluoroamino cation nf2+  
658 F2O Difluorine monoxide f2o  
659 SF2- sulfur difluoride anion sf2-  
660 SF2+ sulfur difluoride cation sf2+  
661 Cl2O Dichlorine monoxide cl2o  
662 SCl2 Sulfur dichloride scl2  
663 BrOCl Bromine hypochlorite brocl  
664 BrOBr Bromine oxide brobr  
665 F3- trifluoride anion f3-  
666 Cl3- trichloride anion cl3-  
667 I3- triiodide i3-  
668 HCCF+ fluoroacetylene cation hccf+  
669 HCCCl Chloroacetylene hcccl  
670 HFCO formyl fluoride hfco  
671 HFCO+ formyl fluoride cation hfco+  
672 COHCl Formyl chloride cohcl  
673 COHBr Formyl bromide cohbr  
674 BHF2 Difluoroborane bhf2  
675 BHCl2 Borane, dichloro- bhcl2  
676 CHCl2 dichloromethyl radical chcl2  
677 HOClO Chlorous acid hoclo  
678 CH2FCl fluorochloromethane ch2fcl  
679 CH2BrF Methane, bromofluoro- ch2fbr  
680 CH2FI fluoroiodomethane ch2fi  
681 CH2ClI chloroiodomethane ch2cli  
682 CH2BrI bromoiodomethane ch2bri  
683 CH2I2 Diiodomethane ch2i2  
684 SiH2Cl2 dichlorosilane sih2cl2  
685 CH2CHF+ fluoroethene cation ch2chf+  
686 C2H3Cl Ethene, chloro- ch2chcl  
687 C2H3Br vinyl bromide c2h3br  
688 C2H3I Vinyl iodide c2h3i  
689 CH3OCl methyl hypochlorite ch3ocl  
690 C2H5F fluoroethane c2h5f  
691 CH3CH2Cl Ethyl chloride c2h5cl  
692 CH3SiFH2 fluoromethylsilane ch3sifh2  
693 C2H5I Ethyl iodide c2h5i  
694 KrF2 Krypton difluoride krf2  
695 XeF2 Xenon difluoride xef2  
696 B4H10 Tetraborane(10) b4h10  
697 C4+ Carbon tetramer cation c4+  
698 C4H2 Diacetylene c4h2  
699 C2H3CCH 1-Buten-3-yne c2h3cch  
700 C4H4 cyclobutadiene cbd  
701 H2CCCCH2 Butatriene h2cccch2  
702 C4H6 1-Methylcyclopropene c3100047  
703 C4H6 Cyclobutene c822355  
704 C4H6 Methylenecyclopropane c6142730  
705 CH2CCHCH3 1,2-Butadiene butad12  
706 CH2CHCHCH2 1,3-Butadiene c106990  
707 CH3CCCH3 2-Butyne c503173  
708 CHCCH2CH3 1-Butyne c107006  
709 CH3CHCHCH2 methylallyl radical c4h7  
710 C4H8 methylcyclopropane mcp  
711 CH2C(CH3)CH3 1-Propene, 2-methyl- isobute  
712 CH3CHCHCH3 2-Butene, (E)- bute2e  
713 CH3CHCHCH3 2-Butene, (Z)- bute2z  
714 B(CH3)3 trimethylborane bme3  
715 Al(CH3)3 trimethyl aluminum tma  
716 C(CH3)3 Tert-butyl radical tbutyl  
717 CH2CH(CH3)2 Isobutyl radical isobutyl  
718 CH3CHCH2CH3 2-Butyl radical butyl2  
719 CH3CH(CH3)CH3 Isobutane isobutane  
720 SiH(CH3)3 trimethylsilane trimsi  
721 Li3N trilithium nitride li3n  
722 C2N2 Cyanogen c2n2  
723 C2N2+ Cyanogen cation c2n2+  
724 P4 Phosphorus tetramer p4  
725 HCCCN Cyanoacetylene hcccn  
726 C3H3N acrylonitrile ch2chcn  
727 C3H3N+ acrylonitrile cation ch2chcn+  
728 CH3N3 methyl azide ch3n3  
729 NH2CCNH2 Diaminoacetylene daa  
730 NH2CH2CN Aminoacetonitrile aan  
731 CH3NHN2+ methyl azide, protonated ch3nhn2+  
732 CH5N3 Guanidine guanidine  
733 C4H6 Bicyclo[1.1.0]butane c157335  
734 CH3NNCH3 (Z)-1,2-Dimethyldiazene dmdiazz  
735 CH6N3+ guanidinium ch6n3+  
736 C3H7N Cyclopropylamine cpram  
737 C3H7N Azetidine azet  
738 C4H8 cyclobutane cbutane  
739 C2H8N2 Ethylenediamine ethdiam  
740 CH3NHNHCH3 dimethyl hydrazine dmh  
741 CH3CH(NH2)CH3 2-Propanamine pram2  
742 N(CH3)3 Trimethylamine trimeam  
743 P(CH3)3 trimethylphosphine tmp  
744 As(CH3)3 trimethyl arsine tmas  
745 (CH3)3NH+ protonated trimethyl amine ptma  
746 C3H7NH3+ n-propylamine, protonated c3h7nh2  
747 Li2O2 dilithium dioxide li2o2  
748 C3O Tricarbon monoxide c3o  
749 B2O2 Diboron dioxide b2o2  
750 CO3 Carbon trioxide co3  
751 CO3-- carbonate co3--  
752 NO3 Nitrogen trioxide no3  
753 NO3- nitrate anion no3-  
754 NO3+ nitrogen trioxide cation no3+  
755 SO3- Sulfur trioxide anion so3-  
756 SO3+ Sulfur trioxide cation so3+  
757 SeO3 selenium trioxide seo3  
758 TeO3 Tellurium trioxide teo3  
759 HCO3- bicarbonate anion hco3-  
760 HSO3 Hydroxysulfonyl radical hso3  
761 NH2NO2 nitramide nh2no2  
762 C2H2CO cyclopropenone c2h2co  
763 HCCCHO 2-propynal hcccho  
764 C2H2O2+ Ethanedial cation c2h2o2+  
765 H2CO3 Carbonic acid h2co3  
766 H2CS3 thiocarbonic acid h2cs3  
767 H2NO3+ Nitric Acid, Protonated h2no3+  
768 H2SO3 Sulfurous acid h2so3  
769 C2H3NO Nitrosoethylene c2h3no  
770 CH3COO- acetate anion ch3coo-  
771 CH3ONO Methyl nitrite ch3ono  
772 NH2COOH Carbamic acid nh2cooh  
773 H3BO3 Boric acid h3bo3  
774 H3CO3+ carbonic acid, protonated h3co3+  
775 C3H4O 2-Propyn-1-ol c107197  
776 C3H4O allenol c9000071  
777 C3H4O Cyclopropanone cpone  
778 C3H4O Methylketene c6004440  
779 NH2CONH2 Urea urea  
780 NH2CONH2+ Urea cation urea+  
781 NH2CSNH2 Thiourea thiourea  
782 C2H4O2 1,3-dioxetane c2h4o2  
783 CH3COOH Acetic acid ch3cooh  
784 CH3OCHO methyl formate ch3ocho  
785 CHOCH2OH hydroxy acetaldehyde haa  
786 NH2COOH2+ Carbamic acid, O-protonated nh2cooh2+  
787 NH3COOH+ protonated Carbamic acid nh3cooh+  
788 H2OHCOOH Water formic acid dimer 1 h2ohcooh_10  
789 H2OHCOOH Water formic acid dimer 2 h2ohcooh_11  
790 HCOOHH2O Formic acid water dimer hcoohh2o  
791 HOCH2OOH hydroxy methyl peroxide hoch2ooh  
792 CH3COCH2 Acetonyl radical ch3coch2  
793 CH3CHNOH Acetaldoxime acetaldoxime  
794 CH3CONH2 Acetamide acetamide  
795 HCONHCH3 N-methylformamide nmfa  
796 CH5N2O+ urea, N-protonated ch4n2o+  
797 H2NCOHNH2+ urea, protonated ureah+  
798 C2H5OO ethylperoxy radical c2h5oo  
799 CH3NNCH3 (E)-1,2-Dimethyldiazene dmdiaze  
800 C3H5OH Cyclopropanol cproh  
801 C3H6O 2-Propen-1-ol c107186  
802 C3H6O Oxetane oxetane  
803 C3H6O Propylene oxide prox  
804 CH3COCH3 Acetone acetone  
805 CH3COCH3- acetone anion ch3coch3-  
806 C3H6S Thietane thietane  
807 C3H6S Thiirane, methyl- methiirane  
808 CH3CSCH3 Thioacetone ch3csch3  
809 C2H6O2 1,2-Ethanediol ethdiol  
810 CH3OOCH3 dimethylperoxide dmp  
811 CH3SOCH3 Dimethyl sulfoxide dmso  
812 CH2SHCH2SH 1,2-Ethanedithiol ethdisl  
813 CH3SSCH3 Disulfide, dimethyl ch3ssch3  
814 CH3COHCH3+ acetone, protonated acetoneh+  
815 HOCH2CH2NH2 monoethanolamine mea  
816 CH3CHOHCH3 Isopropyl alcohol isoproh  
817 CH3OC2H5 Ethane, methoxy- etome  
818 C3H7SH 1-Propanethiol prsh  
819 CH3CHSHCH3 2-Propanethiol isoprsh  
820 CH3SCH2CH3 Ethane, (methylthio)- etsme  
821 H2OCH3OCH3 water dimethylether dimer h2och3och3  
822 Na2F2 Sodium Fluoride Dimer na2f2  
823 Na2Cl2 Disodium dichloride na2cl2  
824 C2F2 difluoroacetylene c2f2  
825 C2Cl2 dichloroacetylene c2cl2  
826 C2Cl2+ dichloroacetylene cation c2cl2+  
827 FNO2 Nitryl fluoride fno2  
828 FONO Nitrosyl hypofluorite fono  
829 ClNO2 Nitryl chloride clno2  
830 ClONO chlorine nitrite clono  
831 BrONO Bromine nitrite brono  
832 N2F2 (Z)-Difluorodiazene n2f2_z  
833 N2F2 Dinitrogen difluoride, (E)- n2f2_e  
834 COFCl Carbonic chloride fluoride cofcl  
835 CCl2O Phosgene cl2co  
836 Cl2CS Thiophosgene cl2cs  
837 COBr2 Carbonic dibromide cobr2  
838 BF3- Borane, trifluoro- anion bf3-  
839 AlF2Cl Aluminum chloride difluoride alclf2  
840 ScF3 Scandium trifluoride ScF3  
841 AlFCl2 Aluminum dichloride fluoride alcl2f  
842 AlCl3 Aluminum trichloride alcl3  
843 BBr3 Boron tribromide bbr3  
844 AlBr3 Aluminum Bromide albr3  
845 ClO3 Chlorine trioxide clo3  
846 ClO3- chlorate anion clo3-  
847 BrO3- Bromate anion bro3-  
848 CF3 Trifluoromethyl radical cf3  
849 CF3- Trifluoromethyl anion cf3-  
850 CF3+ Trifluoromethyl cation cf3+  
851 SiF3 Silicon trifluoride radical sif3  
852 SiF3+ Silicon trifluoride cation sif3+  
853 CCl3 Trichloromethyl radical ccl3  
854 CCl3- Trichloromethyl anion ccl3-  
855 CCl3+ Trichloromethyl cation ccl3+  
856 SiCl3 trichlorosilyl radical sicl3  
857 SiCl3+ trichlorosilyl cation sicl3+  
858 FOOF Perfluoroperoxide foof  
859 F2SO Thionyl Fluoride f2so  
860 ClOOCl Dichlorine dioxide cloocl  
861 FSSF Difluorodisulfane fssf  
862 S2F2 Thio-thionyl fluoride s2f2  
863 SOCl2 thionyl chloride socl2  
864 SeOCl2 selenium oxychloride seocl2  
865 NF3- Nitrogen trifluoride anion nf3-  
866 NF3+ Nitrogen trifluoride cation nf3+  
867 PF3 Phosphorus trifluoride pf3  
868 AsF3 Arsenic trifluoride asf3  
869 PCl3 Phosphorus trichloride pcl3  
870 SbF3 Antimony Trifluoride sbf3  
871 AsCl3 Arsenous trichloride ascl3  
872 SbCl3 Antimony Trichloride sbcl3  
873 PBr3 Phosphorus tribromide pbr3  
874 AsBr3 Arsenic tribromide asbr3  
875 NI3 Nitrogen triiodide ni3  
876 PI3 Phosphorus triiodide pi3  
877 ClSSCl Disulfur dichloride s2cl2  
878 SF3 Sulfur trifluoride sf3  
879 ClF3 Chlorine trifluoride clf3  
880 BrF3 Bromine trifluoride brf3  
881 IF3 iodone trifluoride if3  
882 CHF2Cl difluorochloromethane chf2cl  
883 CHFCl2 fluorodichloromethane chfcl2  
884 CDCl3 trichloromethane-d cdcl3  
885 CHCl3 Chloroform chcl3  
886 SiHCl3 Trichlorosilane sihcl3  
887 CHFClBr fluorochlorobromomethane chfclbr  
888 CHF2I difluoroiodomethane chf2i  
889 CHFClI fluorochloroiodomethane chfcli  
890 CHCl2I dichloroiodomethane chcl2i  
891 CHClBr2 Methane, dibromochloro- chclbr2  
892 CHBr3 bromoform chbr3  
893 CHI3 Iodoform chi3  
894 NF3H+ protonated nitrogen trifluoride nf3h+  
895 C2H2F2 Ethene, 1,2-difluoro-, (E)- c2h2f2e  
896 C2H2F2 Ethene, 1,2-difluoro-, (Z)- c2h2f2z  
897 CH2CF2 Ethene, 1,1-difluoro- ch2cf2  
898 CH2CCl2 Ethene, 1,1-dichloro- ch2ccl2  
899 CHClCHCl Ethene, 1,2-dichloro-, (E)- chclchcle  
900 CHClCHCl Ethene, 1,2-dichloro-, (Z)- chclchclz  
901 C2H2Br2 1,1-dibromoethene c2h2br2  
902 CH2FCHO Fluoroacetaldehyde ch2fcho  
903 CH3COF Acetyl fluoride ch3cof  
904 CH2ClCHO chloroacetaldehyde ch2clcho  
905 CH3COCl Acetyl Chloride ch3cocl  
906 CH2FCH2Cl Ethane, 1-chloro-2-fluoro- ch2fch2cl  
907 CH3CHFCl Ethane, 1-chloro-1-fluoro- ch3chfcl  
908 CH2ClCH2Cl Ethane, 1,2-dichloro- ch2clch2cl  
909 CH3CHCl2 Ethane, 1,1-dichloro- ch3chcl2  
910 CH2CFCH3 2-fluoropropene 2fpro  
911 C3H5Cl 1-Propene, 3-chloro- prop1cl3  
912 C3H5Cl 1-chloro-1-propene(E) prop1cl1e  
913 C3H5Cl 1-chloro-1-propene(Z) prop1cl1z  
914 CH2ClCH2OH 2-Chloroethanol ch2clch2oh  
915 CH2ClCH2OH2+ 2-chloroethanol, protonated ch2clch2oh2+  
916 CH2ClCH2CH3 Propane, 1-chloro- prcl1  
917 CH3CHClCH3 Propane, 2-chloro- prcl2  
918 CH3CH2CH2Br n-propyl bromide prbr  
919 CH3CHBrCH3 i-propyl bromide iprbr  
920 C3H9O+ trimethyl oxonium cation c3h9o+  
921 C5H5 cyclopentadienyl radical c5h5  
922 C5H5- cylopentadienyl anion c5h5-  
923 C5H6 1,3-Cyclopentadiene c542927  
924 C5H6 1-Buten-3-yne, 2-methyl- c78808  
925 C5H6 3-Penten-1-yne, (E)- c2004695  
926 C5H6 3-Penten-1-yne, (Z)- c1574409  
927 C5H6 Bicyclo[2.1.0]pent-2-ene c5164352  
928 C5H6 Cyclopropylacetylene c6746947  
929 C5H7 1,3-pentadienyl radical pdyl  
930 C5H7 cyclopentenyl radical cpyl  
931 C5H8 1,2-Butadiene, 3-methyl- c598254  
932 C5H8 1,2-Pentadiene c591957  
933 C5H8 1,3-Butadiene, 2-methyl- c78795  
934 C5H8 1,3-Pentadiene, (E)- c2004708  
935 C5H8 1,3-Pentadiene, (Z)- c1574410  
936 C5H8 1,4-Pentadiene c591935  
937 C5H8 1-pentyne a1pentyne  
938 C5H8 2,3-Pentadiene c591968  
939 C5H8 Cyclobutane, methylene- c1120565  
940 C5H8 Cyclopentene c142290  
941 C5H8 Ethenylcyclopropane c693867  
942 CH3CCCH2CH3 2-Pentyne 2pentyne  
943 C5H10 1-Butene, 2-methyl- c563462  
944 C5H10 2-Butene, 2-methyl- c513359  
945 C5H10 2-Pentene, (E)- c646048  
946 C5H10 2-Pentene, (Z)- c627203  
947 C5H10 Cyclopentane c287923  
948 C5H10 Cyclopropane, 1,1-dimethyl- c1630940  
949 CH2CHCH2CH2CH3 1-pentene pentene  
950 C5H11 2-Methylbut-2-yl radical c4348350  
951 C5H12 Butane, 2-methyl- buta2  
952 C5H12 Pentane pentane  
953 C5H12 Propane, 2,2-dimethyl- neopentane  
954 Si(CH3)4 tetramethylsilane tms  
955 N2O3 Dinitrogen trioxide n2o3  
956 C3H2N2 Malononitrile c3h2n2  
957 CH2N4 1H-Tetrazole 1htz  
958 C3H3N2 imidazolyl radical im  
959 C3H3N2- imidizolyl anion im-  
960 C2H3N3 1H-1,2,4-Triazole c288880  
961 C4H4N pyrrolide radical c4h4n  
962 C4H4N- pyrrolide anion c4h4n-  
963 C3H4N2 1H-Imidazole 1himidaz  
964 C3H4N2 1H-Pyrazole 1hpyraz  
965 C3H4N2 4H-Imidazole imid4h  
966 C4H5N (E)-2-Butenenitrile c627269  
967 C4H5N (Z)-2-Butenenitrile c1190767  
968 C4H5N 2H-pyrrole pyrrole2  
969 C4H5N 3H-pyrrole pyrrole3  
970 C4H5N Cyclopropanecarbonitrile c5500210  
971 CH2CHCH2CN Allylcyanide ch2chch2cn  
972 C4H6N+ pyrrole, alpha-protonated appyr  
973 C4H6N+ pyrrole, beta-protonated bppyr  
974 C4H6N+ pyrrole, protonated ppyr  
975 C3H6N2 3-Aminopropionitrile c151188  
976 CH3CH(CH3)CN Propanenitrile, 2-methyl- c4h7n  
977 CH3CH2CH2CN Butanenitrile c109740  
978 C5H8 Bicyclo[2.1.0]pentane c185944  
979 C5H8 Spiropentane c157404  
980 C4H9N Cyclobutylamine cbam  
981 C4H9N Pyrrolidine pyrrolidine  
982 C3H10N2 1,2-Diaminopropane diampr12  
983 C(CH3)3NH2 2-Propanamine, 2-methyl- c75649  
984 C(NH2)H2C(CH3)HCH3 1-Propanamine, 2-methyl- c78819  
985 C(NH2)H2CH2CH2CH3 1-Butanamine butam1  
986 CH3C(NH2)HCH2CH3 2-Butanamine butam2  
987 NH(C2H5)2 diethylamine dea  
988 NC4H12+ tetramethyl ammonium cation nc4h12+  
989 C3O2+ Carbon suboxide cation c3o2+  
990 MgCO3 Magnesium Carbonate mgco3  
991 BeCO3 Beryllium Carbonate beco3  
992 CaCO3 Calcium Carbonate caco3  
993 ONONO Nitrosyl nitrite onono  
994 PO4--- phosphate po4---  
995 SO4-- sulfate so4--  
996 HOONO2 peroxy nitric acid hoono2  
997 HSO4- bisulfate anion hso4-  
998 C2H2N2S 1,3,4-Thiadiazole c2h2n2s  
999 C3H2O2 Propiolic acid c3h2o2  
1000 CHOCOOH oxo acetic acid oaa  
1001 H2SO4 Sulfuric acid h2so4  
1002 H2SeO4 Selenic acid h2seo4  
1003 C3H3NO Oxazole oxazole  
1004 CH3C(O)OO acetyl peroxy radical ch3coo2  
1005 CH3NO3 Methyl nitrate ch3no3  
1006 H3PO4 Phosphoric Acid h3po4  
1007 C4H4O Furan furan  
1008 C4H4O+ Furan cation furan+  
1009 C4H4S Thiophene furans  
1010 C3H4O2 β–Propiolactone beta  
1011 C3H4O2 2-Propenoic acid propenoic2  
1012 C3H4O2 Methyl glyoxal megly  
1013 C3H4O2 propanedial propanedial  
1014 C3H4O2 propenalol propenalol  
1015 HOCHCCHOH allenediol aldiol  
1016 C2H4O3 1,2,3-trioxolane c2h4o3  
1017 C2H4O3 trioxolane124 triox  
1018 HOCH2COOH Hydroxyacetic acid hac  
1019 CH2CHCONH2 Acrylamide c79061  
1020 CH3OCH2CN Methoxyacetonitrile c1738369  
1021 CH5N3S Hydrazinecarbothioamide c79196  
1022 H2NCH2COOH Glycine glycine  
1023 CH3SO2NH2 methanesulfonamide ch3so2nh2  
1024 C4H6O cis-2-butenal butenal2c  
1025 C4H6O Cyclobutanone cbutone  
1026 C4H6O Furan, 2,3-dihydro- furan23h  
1027 C4H6O Furan, 2,5-dihydro- furan25h  
1028 CH2CHOCHCH2 Vinyl ether vinylether  
1029 CHOCHCHCH3 2-Butenal butenal2  
1030 C4H6S Thiophene, 2,3-dihydro- thiop23h  
1031 C4H6S Thiophene, 2,5-dihydro- thiop25h  
1032 CH2CHSCHCH2 Divinyl sulfide divis  
1033 C2H6N2O Urea, methyl- c598505  
1034 C3H6O2 1,3-Dioxolane dioxolane  
1035 CH3CH2COOH Propanoic Acid propanoic  
1036 CH3COOCH3 methyl acetate aame  
1037 CH3SSSCH3 dimethyl trisulfide c2h6s3  
1038 C3H7NO dimethylformamide dmf  
1039 C3H7NO Propanamide propanam  
1040 C2H3OC2H5 Ethene, ethoxy- c109922  
1041 C4H8O Cyclobutanol c2919235  
1042 C4H8O Furan, tetrahydro- thf  
1043 CH2C(CH3)OCH3 1-Propene, 2-methoxy- pre1meo2  
1044 CH3COCH2CH3 2-Butanone buta2one  
1045 CHOCH(CH3)CH3 Propanal, 2-methyl- c78842  
1046 CHOCH2CH2CH3 Butanal butanal  
1047 C3H8O2 1,3-Propanediol c504632  
1048 C3H8O2 Hydroperoxide, 1-methylethyl c3031752  
1049 C3H8O2 Methane, dimethoxy- c109875  
1050 C3H8O2 Propylene glycol c57556  
1051 C3H8S2 1,3-Propanedithiol c109808  
1052 C4H10O 1-Butanol butanol1  
1053 C4H10O 1-Propanol, 2-methyl- c78831  
1054 C4H10O 2-Butanol, (.+/-.)- butanol2  
1055 C4H10O Ethanol, 1,1-dimethyl- tbuoh  
1056 C4H10O Ethoxy ethane etoet  
1057 C4H10O Propane, 2-methoxy- c598538  
1058 C4H10O+ 1-Butanol cation butanol1+  
1059 C2H5SC2H5 Diethyl sulfide etset  
1060 CH2(SH)CH(CH3)CH3 1-Propanethiol, 2-methyl- c513440  
1061 CH3C(SCH3)HCH3 Propane, 2-(methylthio)- mesipr  
1062 CH3CH(SH)CH2CH3 2-Butanethiol butansl2  
1063 FNO3 Fluorine nitrate fno3  
1064 ClONO2 Chlorine nitrate clono2  
1065 BrONO2 Bromine nitrate brono2  
1066 TiCl4 Titanium tetrachloride ticl4  
1067 ClO4- perchlorate anion clo4-  
1068 BF4- tetrafluoroboron anion bf4-  
1069 ClFO3 Perchloryl fluoride clfo3  
1070 SO2F2 Sulfuryl fluoride so2f2  
1071 SO2Cl2 Sulfuryl chloride so2cl2  
1072 F3NO Nitrogen trifluoride oxide f3no  
1073 F3PO Phosphoryl fluoride pf3o  
1074 Cl3PO Phosphoryl chloride pcl3o  
1075 CF4 Carbon tetrafluoride cf4  
1076 SiF4 Silicon tetrafluoride sif4  
1077 TiF4 Titanium tetrafluoride tif4  
1078 CFCl3 Trichloromonofluoromethane cfcl3  
1079 GeF4 Germanium tetrafluoride gef4  
1080 CCl4 Carbon tetrachloride ccl4  
1081 CCl4+ Carbon tetrachloride cation ccl4+  
1082 CBrClF2 Methane, bromochlorodifluoro- cbrclf2  
1083 SiCl4 Silane, tetrachloro- sicl4  
1084 CF3I trifluoroiodomethane cf3i  
1085 CBrCl3 Methane, bromotrichloro- cbrcl3  
1086 CBr2F2 Methane, dibromodifluoro- cbr2f2  
1087 GeCl4 Germanium Tetrachloride gecl4  
1088 CCl3I trichloroiodomethane ccl3i  
1089 CFBr3 fluorotribromomethane cfbr3  
1090 CFClBrI fluorochlorobromoiodomethane cfclbri  
1091 CF2I2 difluorodiiodomethane cf2i2  
1092 CBr4 Carbon tetrabromide cbr4  
1093 CCl2I2 dichlorodiiodomethane ccl2i2  
1094 SiBr4 Silicon tetrabromide sibr4  
1095 CBr3I tribromoiododmethane cbr3i  
1096 CI4 tetraiodomethane ci4  
1097 SiI4 silicon tetraiodide sii4  
1098 ClOF3 Chlorine trifluoride oxide clof3  
1099 C2HF3 Trifluoroethylene c2hf3  
1100 C2HF3+ Trifluoroethylene cation c2hf3+  
1101 CHClCCl2 Trichloroethylene chclccl2  
1102 CHBrCF2 1-Bromo-2,2-difluoroethylene chbrcf2  
1103 HClO4 perchloric acid hclo4  
1104 HSO3F Fluorosulfonic acid hso3f  
1105 CF3OH trifluoromethanol cf3oh  
1106 CHClCCHCl 1,3-dichloroallene chclcchcl  
1107 PF3CH2 phosphorane, trifluoromethylene- pf3ch2  
1108 CH3CF3 Ethane, 1,1,1-trifluoro- ch3cf3  
1109 CH3CF2Cl 1-Chloro-1,1-Difluoroethane ch3cf2cl  
1110 CH3CFCl2 1,1-Dichloro-1-fluoroethane ch3cfcl2  
1111 CH2ClCHCl2 1,1,2-trichloroethane ch2clchcl2  
1112 CH3CCl3 Ethane, 1,1,1-trichloro- ch3ccl3  
1113 SiCl3CH3 methyltrichlorosilane sicl3ch3  
1114 CH3CBr3 1,1,1-tribromoethane ch3cbr3  
1115 NH3BCl3 Amminetrichloroboron nh3bcl3  
1116 SiH3CCl3 (trichloromethyl)silane sih3ccl3  
1117 C3H5ClO Oxirane, (chloromethyl)- c106898  
1118 CH3CF2CH3 2,2-difluoropropane ch3cf2ch3  
1119 CH2ClCH2CH2Cl 1,3-dichloropropane prdicl13  
1120 CH2ClCHClCH3 Propane, 1,2-dichloro- prdicl12  
1121 CH3CCl2CH3 Propane, 2,2-dichloro- prdicl22  
1122 CHCl2CH2CH3 1,1-dichloropropane prdicl11  
1123 SiCl2(CH3)2 dichlorodimethylsilane sicl2me2  
1124 CH2CClCH2CH3 1-Butene, 2-chloro- bute1cl2  
1125 CH2CHCH2CH2Cl 1-Butene, 4-chloro- bute1cl4  
1126 CH2CHCHClCH3 1-Butene, 3-chloro- bute1cl3  
1127 CH2ClCHCHCH3 2-Butene, 1-chloro- bute2cl1  
1128 CH3CClCHCH3 2-Butene, 2-chloro-, (E)- bute2cl2e  
1129 CH3CClCHCH3 2-Butene, 2-chloro-, (Z)- bute2cl2z  
1130 CHClCHCH2CH3 (E)-1-Chloro-1-butene bute1cl1  
1131 CHClCHCH2CH3 (Z)-1-Chloro-1-butene bute1cl1z  
1132 C4H9F 1-fluorobutane butaf1  
1133 CH3CHFCH2CH3 2-fluorobutane butaf2  
1134 CH2ClCH2CH2CH3 Butane, 1-chloro- butacl1  
1135 CH3CCl(CH3)CH3 Propane, 2-chloro-2-methyl- procl2me2  
1136 CH3CHClCH2CH3 Butane, 2-chloro- butacl2  
1137 XeF4 Xenon tetrafluoride xef4  
1138 CF3PH2 phosphine, (trifluoromethyl)- cf3ph2  
1139 NH3BF3 Amminetrifluoroboron nh3bf3  
1140 C6H2 hexatriyne c6h2  
1141 C6H4 (E)-Hexa-1,5-diyne-3-ene c6h4e  
1142 C6H4 (Z)-Hexa-1,5-diyne-3-ene c6h4z  
1143 C6H4 Benzyne benzyne  
1144 C6H5 phenyl phenyl  
1145 C6H5- phenyl anion phenyl-  
1146 C6H6 2,4-Hexadiyne hexadiyne  
1147 C6H6 3,4-Dimethylenecyclobutene cb34m  
1148 C6H6 Benzene benzene  
1149 C6H6 Hexa-1,5-diene-3-yne hdy153  
1150 C6H6 Trimethylenecycopropane tmcp  
1151 C6H6+ Benzene cation c6h6+  
1152 C6H7+ benzene, protonated c6h7+  
1153 C6H8 (E)-hexa-1,3,5-triene c821078  
1154 C6H8 (E)-hexa-2,3,4-triene c59660650  
1155 C6H8 (Z)-hexa-1,3,5-triene hexatri135  
1156 C6H8 (Z)-hexa-2,3,4-triene hetr234c  
1157 C6H8 1,3-Cyclohexadiene cyhexadiene13  
1158 C6H8 1,4-Cyclohexadiene cyhexadiene14  
1159 C6H8 3-Methylenecyclopentene c930267  
1160 C6H8 Bicyclo[2.1.1]hex-2-ene c822413  
1161 C6H8 Bicyclo[2.2.0]hex-1(4)-ene c30830207  
1162 C6H8 Bicyclo[3.1.0]hex-2-ene c694019  
1163 C6H10 1,3-Hexadiene, (E)- hexdi13e  
1164 C6H10 1,3-Hexadiene, (Z)- hexdi13z  
1165 C6H10 1,4-Hexadiene, (E)- hexdi14t  
1166 C6H10 1,4-Hexadiene, (Z)- hexdi14z  
1167 C6H10 1,5-Hexadiene c592427  
1168 C6H10 1-Butyne, 3,3-dimethyl- c917920  
1169 C6H10 1-Hexyne hexyne1  
1170 C6H10 2,4-Hexadiene, (E,E)- hexdi24ee  
1171 C6H10 2,4-Hexadiene, (E,Z)- hexdi24ez  
1172 C6H10 2,4-Hexadiene, (Z,Z)- hexdi24zz  
1173 C6H10 2-Hexyne c764352  
1174 C6H10 3-Hexyne hexyne3  
1175 C6H10 cyclohexene cyclohexene  
1176 C6H10 Cyclopentene, 1-methyl- c693890  
1177 C6H10 Cyclopentene, 3-methyl- c1120623  
1178 C6H10 Cyclopentene, 4-methyl- c1759815  
1179 C4H6(CH3)2 1,1-dimethylcyclobutane dmcb11  
1180 C6H12 (1R,2R)-1,2-dimethylcyclobutane dmcb12t  
1181 C6H12 (1r,3r)-1,3-dimethylcyclobutane dmcb13t  
1182 C6H12 (E)-2-Hexene e2hexene  
1183 C6H12 (E)-3-methylpent-2-ene c616126  
1184 C6H12 (E)-hex-3-ene e3hexene  
1185 C6H12 (Z)-3-methylpent-2-ene c922623  
1186 C6H12 (Z)-hex-2-ene z2hexene  
1187 C6H12 (Z)-hex-3-ene z3hexene  
1188 C6H12 2,3-dimethylbut-1-ene c563780  
1189 C6H12 2,3-dimethyl-but-2-ene tmeet  
1190 C6H12 3-methylenepentane c760214  
1191 C6H12 cis-1,2-dimethylcyclobutane dmcb12c  
1192 C6H12 cis-1,3-dimethylcyclobutane dmcb13c  
1193 C6H12 Cyclohexane cyclohexane  
1194 C6H12 Cyclopentane, methyl- c96377  
1195 C6H12 Ethylcyclobutane c4806615  
1196 C6H12 hex-1-ene hexene1  
1197 C6H14 Butane, 2,2-dimethyl- buta22  
1198 C6H14 Butane, 2,3-dimethyl- buta23  
1199 C6H14 Hexane hexane  
1200 C6H14 Pentane, 2-methyl- penta2  
1201 C6H14 Pentane, 3-methyl- penta3  
1202 C4N2 2-Butynedinitrile c4n2  
1203 C4H2N2 Fumaronitrile c4h2n2  
1204 C2H2N4 sym-tetrazine ttz  
1205 C3H3N3 1,3,5-Triazine triazine135  
1206 CH3N5 5-Aminotetrazole c4418615  
1207 C4H4N2 1,3-Diazine diazine13  
1208 C4H4N2 Pyrazine pyrazine  
1209 C4H4N2 Pyridazine pyridazine  
1210 C4H4N2 Succinonitrile c110612  
1211 C2H4N4 1H-Tetrazole, 1-methyl- c16681779  
1212 C2H4N4 1H-Tetrazole, 5-methyl- c4076362  
1213 C2H4N4 2H-Tetrazole, 2-methyl- c16681780  
1214 C5H5N Bicyclo[1.1.0]butane-1-carbonitrile bibucn  
1215 C5H5N E-2,4-pentadienenitrile bdcn  
1216 C5H5N Pyridine pyridine  
1217 B3N3H6 borazine borazine  
1218 C6H6 Fulvene fulvene  
1219 C5H6N+ Pyridinium c5h6n  
1220 C4H6N2 1H-Imidazole, 2-methyl- c693981  
1221 C5H7N (E)-2-Pentenenitrile c26294984  
1222 C5H7N (E)-3-Pentenenitrile c16529661  
1223 C5H7N (Z)-2-Pentenenitrile c25899507  
1224 C5H7N 1H-Pyrrole, 1-methyl- c96548  
1225 C5H7N Cyclobutanecarbonitrile c4426113  
1226 C5H9N 1,2,3,6-Tetrahydropyridine c694053  
1227 C5H9N Butanenitrile, 2-methyl- c18936179  
1228 C5H9N Pentanenitrile c110598  
1229 C5H9N Propanenitrile, 2,2-dimethyl- c630182  
1230 C6H10 Bicyclo[3.1.0]hexane c285585  
1231 C5H11N Cyclopentanamine cypentam  
1232 C5H11N Piperidine piper  
1233 C4H12N2 1,2-Butanediamine c4426486  
1234 C4H12N2 2-Methyl-1,2-propanediamine c811938  
1235 Li2CO3 Lithium Carbonate li2co3  
1236 Na2CO3 Sodium Carbonate na2co3  
1237 C2O4-- oxalate anion c2o4  
1238 MgSO4 Magnesium Sulfate mgso4  
1239 C2H2O4 Oxalic Acid oxalic  
1240 C2H3NO3 Oxamic acid oxamic  
1241 C4H4O2 2(5H)-Furanone furanone  
1242 C4H4O2 2-Oxetanone, 4-methylene- c674828  
1243 C2H4N2O2 Oxalamide oxalamide  
1244 C2H4N2S2 Ethanedithioamide c79403  
1245 C2H4CO3 Ethylene carbonate etco3  
1246 C3H4O2S 2H-Thiete-1,1-dioxide c7285327  
1247 C3H4S3 1,3-Dithiolane-2-thione c822388  
1248 C2H4O4 Formic acid dimer fadimer  
1249 C4H5NO 3-Methylisoxazole isox3m  
1250 C4H5NO Isoxazole, 5-methyl- c5765446  
1251 C4H5NS 4-Methylthiazole c693958  
1252 C2H5NO3 Nitric acid, ethyl ester c625581  
1253 C5H6O 2-methylfuran furan2m  
1254 C5H6O 3-Methylfuran furan3m  
1255 C5H6S Thiophene, 2-methyl- c554143  
1256 C5H6S Thiophene, 3-methyl- c616444  
1257 C4H6O2 2,3-Butanedione c431038  
1258 C4H6O2 2-Propenoic acid, methyl ester c96333  
1259 C4H6O2 Crotonic Acid crot  
1260 C4H6OS 2,3-dihydrothiophene-2-ol c9000117  
1261 C4H6OS 2,5-dihydrothiophene-3-ol c9000093  
1262 C4H6OS 4,5-dihydrothiophene-2-ol c9000106  
1263 C4H6OS 4,5-dihydrothiophene-3-ol c9000082  
1264 C4H6OS Dihydro-2-(3H)-thiophenone c1003107  
1265 C4H6OS Dihydro-3-(2H)-thiophenone c1003049  
1266 C4H6OS Vinyl sulfoxide c1115157  
1267 CH6N4S Carbonothioic dihydrazide thiacarb  
1268 C2H6N2O2 (E)-Azodioxymethane c37765154  
1269 C2H6N2O2 Dimethylnitroamine c4164287  
1270 C3H6S3 1,3,5-Trithiane c3h6s3  
1271 C3H6S3 Carbonotrithioic acid, dimethyl ester c2314489  
1272 C2H6O3S Sulfurous acid, dimethyl ester c616422  
1273 C4H7NO 2-Pyrrolidinone c616455  
1274 C4H7NO Ethoxyacetonitrile etoaccn  
1275 C4H7NO Methacrylamide c79390  
1276 C4H7NO Oxazole, 4,5-dihydro-2-methyl- c1120645  
1277 HCONH2CN2H4 formamide aminomethanimine dimer d13  
1278 C3H7ONO Propyl nitrite prono  
1279 CH3CH(CH3)ONO Isopropyl nitrite c541424  
1280 CH3CH(NH2)COOH Alanine alanine  
1281 CH3NHCH2COOH Sarcosine sarcosine  
1282 NH2CH2CH2COOH β–alanine betaalanine  
1283 NH2COOC2H5 Urethane urethane  
1284 C5H8O 2H-Pyran, 3,4-dihydro- c110872  
1285 C5H8O Cyclopentanone c120923  
1286 C5H8O Furan, 2,3-dihydro-5-methyl- c1487156  
1287 C5H8O Methyl cyclopropyl ketone c765435  
1288 N(CH3)2CONH2 Urea, N,N-dimethyl- c598947  
1289 NH(CH3)CONH(CH3) Urea, N,N'-dimethyl- c96311  
1290 NH2CONHC2H5 Urea, ethyl- c625525  
1291 C4H8O2 1,3-Dioxane dioxan13  
1292 C4H8O2 1,3-Dioxolane, 2-methyl- c497267  
1293 C4H8O2 1,4-Dioxane dioxan14  
1294 C4H8O2 Ethene, 1,1-dimethoxy- c922690  
1295 C4H8O2 Ethyl acetate c141786  
1296 C4H8OS s-Ethyl thioacetate c625605  
1297 C3H8O3 1,2,3-Propanetriol glycerin  
1298 C3H8O2S (Methylsulfonyl)ethane c594434  
1299 C4H9NO Butanamide c541355  
1300 C4H9NO Propanamide, 2-methyl- c563837  
1301 C5H10O 2-Butanone, 3-methyl- c563804  
1302 C5H10O 2H-Pyran, tetrahydro- c142687  
1303 C5H10O 2-methylbutyraldehyde 2meba  
1304 C5H10O 2-Pentanone mpk  
1305 C5H10O Cyclopentanol c96413  
1306 C5H10O Oxetane, 3,3-dimethyl- c6921353  
1307 C5H10O Pentanal pal  
1308 C5H10S 2H-Thiopyran, tetrahydro- c1613510  
1309 C5H10S 3-Ethylthio-1-propene c5296628  
1310 C5H10S Cyclopentanethiol c1679078  
1311 C5H10S Thiophene, tetrahydro-2-methyl- c1795091  
1312 C5H10S Thiophene, tetrahydro-3-methyl- c4740005  
1313 C4H10O2 1,1-Dimethoxyethane c534156  
1314 C4H10O2 1,3-Butanediol budiol13  
1315 C4H10O2 1,4-Butanediol budiol14  
1316 C4H10O2 Ethane, 1,2-dimethoxy- c110714  
1317 C4H10OS Diethyl sulfoxide c70291  
1318 C4H10S2 1,4-Butanedithiol budisl14  
1319 C4H11NO Diethylhydroxylamine c3710847  
1320 C5H12O 1-Butanol, 2-methyl- c137326  
1321 C5H12O 1-Butanol, 3-methyl- c123513  
1322 C5H12O 1-Pentanol pentanol1  
1323 C5H12O 2-Butanol, 3-methyl- c598754  
1324 C5H12O 2-Pentanol peol2  
1325 C5H12O 3-Pentanol pentan3ol  
1326 C5H12O Butane, 1-methoxy- meobu  
1327 C5H12O Propane, 1-ethoxy- proet  
1328 C5H12O Propane, 2-methoxy-2-methyl- c1634044  
1329 C5H12S 1-Butanethiol, 2-methyl- c1878188  
1330 C5H12S 1-Butanethiol, 3-methyl- c541311  
1331 C5H12S 1-Pentanethiol c110667  
1332 C5H12S 1-Propanethiol, 2,2-dimethyl- c1679089  
1333 C5H12S 2-Butanethiol, 2-methyl- c1679090  
1334 C5H12S 2-Butanethiol, 3-methyl- c2084186  
1335 C5H12S Butane, 1-(methylthio)- c628295  
1336 C5H12S Ethyl propyl sulfide c4110503  
1337 C5H12S Propane, 2-(ethylthio)- c5145993  
1338 C5H12S Propane, 2-methyl-2-(methylthio)- c6163640  
1339 ClCOClCO Oxalyl chloride oxcl  
1340 CF3CN Acetonitrile, trifluoro- cf3cn  
1341 CF3CN+ Acetonitrile, trifluoro- cation cf3cn+  
1342 B2F4 Diboron tetrafluoride b2f4  
1343 B2Cl4 Diboron tetrachloride b2cl4  
1344 C2F4 Tetrafluoroethylene c2f4  
1345 C2F4+ Tetrafluoroethylene cation c2f4+  
1346 CF2CCl2 difluorodichloroethylene cf2ccl2  
1347 CFClCClF trans-1,2-dichloro-1,2-difluoroethylene cfclcclf  
1348 CFClCFCl cis-1,2-dichloro-1,2-difluoroethylene cfclcfcl  
1349 C2FCl3 fluorotrichloroethene c2fcl3  
1350 C2Cl4 Tetrachloroethylene c2cl4  
1351 CF3OF Trifluoromethylhypofluorite cf3of  
1352 SOF4 Sulfur tetrafluoride oxide sof4  
1353 PF5 Phosphorus pentafluoride pf5  
1354 AsF5 Arsenic pentafluoride asf5  
1355 PCl5 Phosphorus pentachloride pcl5  
1356 SF5 Sulfur pentafluoride sf5  
1357 SF5+ pentafluoro sulfur cation sf5+  
1358 SbCl5 Antimony pentachloride sbcl5  
1359 BrF5 bromine pentafluoride brf5  
1360 ClF5 chlorinepentafluoride clf5  
1361 IF5 pentafluoroiodine if5  
1362 CF3CHO trifluoroacetaldehyde cf3cho  
1363 CCl3CHO trichloroacetaldehyde ccl3cho  
1364 CHFClCHClF ethane, 1,2-dichloro-1,2-difluoro- chfclchclf  
1365 CF3CH2F 1,1,1,2-tetrafluoroethane cf3ch2f  
1366 CHF2CHF2 1,1,2,2-tetrafluoroethane chf2chf2  
1367 CF3CH2Cl 2,2,2-Trifluoroethyl chloride cf3ch2cl  
1368 CHFClCHFCl 1,2-dichloro-1,2-difluoroethane RR chfclchfcl  
1369 CH2ClCCl3 1,1,1,2-tetrachloroethane ch2clccl3  
1370 CH2BrCBr3 1,1,1,2-tetrabromo ethane c2h2br4  
1371 CHCl2CHF2 1,1-dichloro-2,2-difluoroethane c2h2cl2f2  
1372 CF3COOH trifluoroacetic acid cf3cooh  
1373 C4H3ClO Furan, 2-chloro fur2cl  
1374 C4H3ClO Furan,3-chloro fur3cl  
1375 C3H5ClO2 Carbonochloridic acid, ethyl ester c541413  
1376 C3H5Cl3 Propane, 1,2,3-trichloro- prcl135  
1377 C4H8Cl2 1,4-Dichlorobutane c110565  
1378 C4H8Cl2 Butane, 1,2-dichloro- c616217  
1379 C4H8Cl2 Butane, 1,3-dichloro- c1190223  
1380 C4H8Cl2 Butane, 2,3-dichloro-, (r*,r*)-(.+/-.)- c2211678  
1381 C4H8Cl2 Butane, 2,3-dichloro-, (r*,s*)- c4028562  
1382 C4H9ClO 1-Chloro-2-ethoxyethane c628342  
1383 C5H11Cl Pentane, 1-chloro- pencl1  
1384 C4H8O2 Butanoic acid bua  
1385 C6H5CH2 benzyl radical benzyl  
1386 C6H5CH3 toluene toluene  
1387 C7H8 cycloheptatriene cht  
1388 C7H8 Norbornadiene norbor  
1389 C7H8 Quadricyclane qucy  
1390 C7H12 Norbornane nor  
1391 C7H14 cycloheptane c7h14  
1392 C7H16 2-methylhexane 2mhex  
1393 C7H16 3-methylhexane hex3m  
1394 C7H16 heptane heptane  
1395 HN=C=C(CN)2 Dicyanoketenimine c4hn3  
1396 C6H7N 2-Methylpyridine mp  
1397 C6H5NH2 aniline aniline  
1398 C6H13N 2-Methylpiperidine pip2m  
1399 C6H13N cyclohexanamine cham  
1400 C6H15N triethylamine tea  
1401 N2O5 Dinitrogen pentoxide n2o5  
1402 C4H2O3 Maleic Anhydride malan  
1403 C5H4O2 4-Cyclopentene-1,3-dione cpdio  
1404 C5H4O2 furfural furfural  
1405 C6H5O phenoxy radical phenoxy  
1406 C5H5NO 2(1H)-Pyridinone c72762006  
1407 C5H5NO 2(3H)-Pyridinone c9000048  
1408 C5H5NO 2(5H)-Pyridinone c9000037  
1409 C5H5NO 2-Pyridinol c109104  
1410 C5H5NO 3(2H)-Pyridinone c9000004  
1411 C5H5NO 3(4H)-Pyridinone c9000026  
1412 C5H5NO 3(6H)-Pyridinone c9000015  
1413 C5H5NO 3-Pyridinol c109002  
1414 C5H5NO 4(1H)-Pryidinone c9000060  
1415 C5H5NO 4(3H)-Pryidinone c9000059  
1416 C5H5NO 4-Pyridinol c626642  
1417 C6H5OH phenol phenol  
1418 C6H6O 2,4-Cyclohexadienone c24599573  
1419 C6H6O 2,5-Cyclohexadienone c5664335  
1420 C6H5SH Benzenethiol phsh  
1421 HO2CCHNH2CH2OH Serine serine  
1422 C5H8O2 Acetylacetone acac  
1423 C4H8O2S Sulfolane sulfolane  
1424 C7H10 Norbornene norbornene  
1425 CH(C2H3)3 trivinyl methane tvm  
1426 C6H10O cyclohexanone chexo  
1427 C6H12O hexanal c6h12o  
1428 C3H7OC3H7 di-n-propyl ether propr  
1429 CF3COO- trifluoro acetate anion cf3coo-  
1430 CF3COF trifluoroacetyl fluoride cf3cof  
1431 CF3COCl trifluoroacetyl chloride cf3cocl  
1432 PF6 Hexafluorophosphate neutral pf6  
1433 PF6- Hexafluorophosphate ion pf6-  
1434 SeF6 Selenium hexafluoride sef6  
1435 SF5Cl sulfur chloropentafluoride sf5cl  
1436 CF3CHF2 pentafluoroethane cf3chf2  
1437 CF3CHFCl 1,1,1,2-tetrafluorochloroethane cf3chfcl  
1438 CF3CHCl2 1,1-Dichloro-2,2,2-trifluoroethane cf3chcl2  
1439 CHCl2CClF2 Ethane, 1,2,2-trichloro-1,1-difluoro- chcl2cclf2  
1440 CCl3CHCl2 pentachloroethane ccl3chcl2  
1441 C6H5F Fluorobenzene bzf  
1442 C6H5Cl chlorobenzene bzcl  
1443 C6H5Br bromobenzene bzbr  
1444 C8H6 Calicene calicene  
1445 C6H5CCH phenylacetylene phac  
1446 C8H6 benzocyclobutadiene bcbd  
1447 C8H6 Pentalene pentalene  
1448 C6H5CHCH2 Styrene styrene  
1449 C8H8 cubane cubane  
1450 C8H8 cyclooctatetraene cot  
1451 C6H5CH2CH3 Ethylbenzene etbz  
1452 CH3C6H4CH3 meta-xylene mxylene  
1453 CH3C6H4CH3 paraxylene pxylene  
1454 C8H14 Bicyclo[2.2.2]octane bico222  
1455 C8H16 cyclooctane cyclooct  
1456 (CH3)3CC(CH3)3 tetramethylbutane tmb  
1457 C8H18 Octane c8h18  
1458 C6H5CN phenyl cyanide phcn  
1459 C6H12N2 Triethylenediamine ted  
1460 C4O4-- squarate dianion c4o4--  
1461 S8 Octasulfur s8  
1462 C6H4O2 parabenzoquinone pbq  
1463 C4H4N2O2 Uracil uracil  
1464 C6H5OCH3 Anisole anisole  
1465 C5H9NO2 Proline proline  
1466 C6H12O2 Methyl pivalate c598981  
1467 C6H12O2 Hexanoic acid hexa  
1468 C4F4 tetrafluorcyclobutadiene c4f4  
1469 Al2Cl6 Aluminum, di-μ-chlorotetrachlorodi- al2cl6  
1470 CF3CF2Cl pentafluorochloroethane cf3cf2cl  
1471 CF2ClCF2Cl 1,2-Dichloro-1,1,2,2-tetrafluoroethane cf2clcf2cl  
1472 CF3CFCl2 1,1-Dichlorotetrafluoroethane cf3cfcl2  
1473 CF2ClCFCl2 Ethane, 1,1,2-trichloro-1,2,2-trifluoro- cf2clcfcl2  
1474 CF3CCl3 1,1,1-trifluoro-2,2,2-trichloroethane cf3ccl3  
1475 C2F6 hexafluoroethane c2f6  
1476 C2Cl6 hexachloroethane c2cl6  
1477 IF7 Iodine heptafluoride if7  
1478 C6H4F2 metadifluorobenzene mdfb  
1479 C6H4F2 orthodifluorobenzene odfb  
1480 C6H4F2 1,4-difluorobenzene pdfb  
1481 C6H4Cl2 1,2-dichlorobenzene dcb12  
1482 C6H4Cl2 1,3-dichlorobenzene dcb13  
1483 C9H8 Indene indene  
1484 C9H8 spiro[4.4]nona-1,3,6,8-tetraene snt  
1485 C9H12 n-propyl benzene prbz  
1486 C9H20 Nonane nonane  
1487 C(CN)4 tetracyanomethane c5n4  
1488 C5H4N4 purine purine  
1489 C8H7N Indole indole  
1490 C3H3N3O3 cyanuric acid cyanuric  
1491 C6H5NO2 Nitrobenzene c6h5no2  
1492 C6H5COOH benzoic acid benzo  
1493 CH3COC6H5 acetophenone acph  
1494 C3Cl3N3 1,3,5-Triazine, 2,4,6-trichloro- c3cl3n3  
1495 C6H3F3 Benzene trifluoride 123 bzf3a  
1496 C10H8 Azulene azu  
1497 C10H8 naphthalene naph  
1498 C10H10 bullvalene bullv  
1499 C10H16 adamantane adamantane  
1500 C6N4 Tetracyanoethylene tcne  
1501 C6N4- tetracyanoethylene anion tcne-  
1502 C10H22 Decane decane  
1503 C4F6 perfluorobutadiene c4f6  
1504 SF5CF3 Sulfur, pentafluoro(trifluoromethyl)- sf5cf3  
1505 C3F8 perfluoropropane c3f8  
1506 Fe(CO)5 Iron pentacarbonyl ipc  
1507 Fe(C5H5)2 ferrocene fecp2  
1508 B12H12-- Dodecahydrododecaborate(2-) b12h12--  
1509 C12H8 Acenaphthylene acenaph  
1510 C12H8 biphenylene biph  
1511 C12H10 biphenyl biphenyl  
1512 C12H10 Heptalene heptalene  
1513 C6H12O6 Inositol inositol  
1514 C6F6 hexafluorobenzene c6f6  
1515 S2F10 disulphur decafluoride s2f10  
1516 C13H10 Fluorene fluorene  
1517 C14H10 Anthracene anth  
1518 C14H10 Phenanthrene phenanthrene  
1519 C12H10N2 azobenzene azobenzene  
1520 C6H5COC6H5 benzophenone benzophenone  
1521 C16H10 Pyrene pyrene  
1522 C18H12 Tetracene tetracene  
1523 C19H16 Triphenylmethane tpm  
1524 C24H12 Coronene coronene  
1525 C60 Buckminsterfullerene c60