return to home page Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
You are here: Resources > Info on Results > Calculations Done > Method and basis set

List of which calculations are completed at B1B95 /CEP-31G*

Jump to calculations not yet done
count Species Name State Conformation
1 D Deuterium atom 1SKh
2 H Hydrogen atom 1SKh
3 H+ Hydrogen atom cation  Kh
4 D2 Deuterium diatomic 1ΣgD∞h
5 H2 Hydrogen diatomic 1ΣgD∞h
6 HD Deuterium hydride 1ΣgD∞h
7 Li Lithium atom 2SKh
8 Na Sodium atom 2SKh
9 LiH Lithium Hydride 1ΣC∞v
10 NaH sodium hydride 1ΣC∞v
11 Be Beryllium atom 1SKh
12 Be+ Beryllium atom cation 2SKh
13 Mg Magnesium atom 1SKh
14 Mg+ Magnesium atom cation 2SKh
15 BeH beryllium monohydride 2ΣC∞v
16 MgH magnesium monohydride 2ΣC∞v
17 BeH2 beryllium dihydride 1ΣgD∞h
18 MgH2 magnesium dihydride 1ΣgD∞h
19 B Boron atom 2PKh
20 B Boron atom 4PKh
21 B+ Boron atom cation 1SKh
22 Al Aluminum atom 2PKh
23 Al+ Aluminum atom cation 1SKh
24 BH Boron monohydride 1ΣC∞v
25 AlH aluminum monohydride 1ΣC∞v
26 BH2 boron dihydride 2A1C2v
27 AlH2 aluminum dihydride 2A1C2v
28 BH3 boron trihydride 1A1'D3h
29 AlH3 aluminum trihydride 1A1'D3h
30 C Carbon atom 3P0Kh
31 C Carbon atom 3P1Kh
32 C+ Carbon atom cation 2PKh
33 Si Silicon atom 3PKh
34 Si Silicon atom 1SKh
35 Si+ Silicon atom cation 2PKh
36 CH Methylidyne 2Π1/2C∞v
37 SiH Silylidyne 2ΠC∞v
38 CH2 Methylene 3B1C2v
39 SiH2 silicon dihydride 1A1C2v
40 CH3 Methyl radical 2A1D3h
41 SiH3 Silyl radical 2A1C3v
42 CH4 Methane 1A1Td
43 SiH4 Silane 1A1Td
44 N+ Nitrogen atom cation 3PKh
45 P Phosphorus atom 4SKh
46 NH Imidogen 3Σ-C∞v
47 PH phosphorus monohydride 3Σ-C∞v
48 ND2 Amidogen-d2 2B1C2v
49 NH2 Amino radical 2B1C2v
50 PH2 Phosphino radical 2B1C2v
51 ND3 Ammonia-d3 1A1C3v
52 NH3 Ammonia 1A1C3v
53 PH3 Phosphine 1A1C3v
54 O Oxygen atom 3SKh
55 O+ Oxygen atom cation 4SKh
56 S Sulfur atom 3PKh
57 DO Hydroxyl-d 2ΠC∞v
58 OH Hydroxyl radical 2ΠC∞v
59 DS Mercapto-d 2ΠC∞v
60 HS Mercapto radical 2ΠC∞v
61 D2O Deuterium oxide 1A1C2v
62 H2O Water 1A1C2v
63 HDO Water-d1 1A1C2v
64 D2S Hydrogen sulfide-d2 1A1C2v
65 H2S Hydrogen sulfide 1A1C2v
66 F Fluorine atom 2PKh
67 F+ Fluorine atom cation 3SKh
68 Cl Chlorine atom 2PKh
69 Cl+ Chlorine atom cation 3PKh
70 DF Hydrofluoric acid-d 1ΣC∞v
71 HF Hydrogen fluoride 1ΣC∞v
72 DCl Hydrochloric acid-d 1ΣC∞v
73 HCl Hydrogen chloride 1ΣC∞v
74 Li2 Lithium diatomic 1ΣgD∞v
75 NaLi lithium sodium 1ΣC∞v
76 Na2 Sodium diatomic 1ΣgD∞h
77 Mg2 Magnesium diatomic 1ΣgD∞h
78 B2 Boron diatomic 3ΣgD∞h
79 Al2 Aluminum diatomic 3ΣgD∞h
80 B2H6 Diborane 1AgD2h
81 C2 Carbon diatomic 1Σg+D∞h
82 Si2 Silicon diatomic 3ΣgD∞h
83 C2H Ethynyl radical 2ΣC∞v
84 C2H2 Acetylene 1ΣgD∞h
85 CCH2 vinylidene 1A1C2v
86 C2H3 vinyl 2A'Cs
87 C2H4 Ethylene 1AgD2h
88 C2H5 Ethyl radical 2A'Cs
89 C2H6 Ethane 1A1gD3d
90 CH3SiH3 methyl silane 1A1C3
91 Si2H6 disilane 1EuD3d
92 BN boron nitride 3ΠC∞v
93 AlN Aluminum nitride 3ΠiC∞v
94 CN Cyano radical 2ΣC∞v
95 SiN Silicon nitride 2ΣC∞v
96 N2 Nitrogen diatomic 1ΣgD∞h
97 PN Phosphorus mononitride 1ΣC∞v
98 P2 Phosphorus diatomic 1ΣgD∞h
99 HNC hydrogen isocyanide 1ΣC∞v
100 HCN Hydrogen cyanide 1ΣC∞v
101 HCP Phosphaethyne 1ΣC∞v
102 NNH Dinitrogen monohydride 2A'Cs
103 HPO Hydrogen phosphorus oxide 1A'Cs
104 N2H2 (E)-diazene 1AgC2h
105 CH2NH Methanimine 1A'Cs
106 CH2PH Phosphaethene 1A'Cs
107 N2H4 Hydrazine 1AC2
108 P2H4 Diphosphine 1AC2
109 CH3NH2 methyl amine 1A'Cs
110 CH3PH2 Methyl phosphine 1A'Cs
111 NH3NH3 Ammonia Dimer 1AgC2h
112 LiO lithium oxide 2ΣC∞v
113 NaO sodium monoxide 2ΣC∞v
114 BeO beryllium oxide 1ΣC∞v
115 MgO magnesium oxide 1Σ+C∞v
116 MgS magnesium sulfide 1ΣC∞v
117 BO boron monoxide 2ΣC∞v
118 AlO Aluminum monoxide 2ΣC∞v
119 AlS Aluminum sulfide 2ΣC∞v
120 CO Carbon monoxide 1ΣC∞v
121 CS carbon monosulfide 1ΣC∞v
122 SiO Silicon monoxide 1ΣC∞v
123 SiS silicon monosulfide 1ΣC∞v
124 NO Nitric oxide 2ΠC∞v
125 NS Mononitrogen monosulfide 2ΠC∞v
126 PO Phosphorus monoxide 2ΠC∞v
127 PS phosphorus sulfide 2ΣC∞v
128 O2 Oxygen diatomic 3ΣgD∞h
129 O2+ diatomic oxygen cation 2ΠgD∞h
130 SO Sulfur monoxide 3ΣC∞v
131 S2 Sulfur diatomic 3ΣgD∞h
132 LiOH lithium hydroxide 1ΣC∞v
133 NaOH sodium hydroxide 1ΣC∞v
134 BeOH beryllium monohydroxide 2A'Cs
135 MgOH magnesium hydroxide 2A'Cs
136 HBO Boron hydride oxide 1ΣC∞v
137 HBS hydrogen boron sulfide 1ΣC∞v
138 HCO Formyl radical 2A'Cs
139 HCS Thioformyl radical 2A'Cs
140 HNO Nitrosyl hydride 1A'Cs
141 HO2 Hydroperoxy radical 2A"Cs
142 H2CO Formaldehyde 1A1C2v
143 H2CS Thioformaldehyde 1A1C2v
144 H2O2 Hydrogen peroxide 1AC2
145 H2S2 Disulfane 1AC2
146 CH2OH Hydroxymethyl radical 2AC1
147 CH3O Methoxy radical 2A'C1
148 CH3S thiomethoxy 2A'C3v
149 NH2OH hydroxylamine 1A'Cs
150 CH3OH Methyl alcohol 1A'Cs
151 CH3SH Methanethiol 1A'Cs
152 H2OH2O water dimer 1A'Cs
153 LiF lithium fluoride 1ΣC∞v
154 LiCl lithium chloride 1ΣC∞v
155 NaF sodium fluoride 1ΣC∞v
156 NaCl Sodium Chloride 1ΣC∞v
157 BeF Beryllium monofluoride 2ΣC∞v
158 BeCl beryllium monochloride 2ΣC∞v
159 MgF Magnesium monofluoride 2ΣC∞v
160 MgCl magnesium monochloride 2ΣC∞v
161 BF Boron monofluoride 1ΣC∞v
162 AlF Aluminum monofluoride 1Σ+C∞v
163 BCl boron monochloride 1ΣC∞v
164 CF Fluoromethylidyne 2ΠC∞v
165 CCl carbon monochloride 2ΠC∞v
166 SiF silicon monofluoride 2ΠC∞v
167 NF nitrogen fluoride 3ΣC∞v
168 PF phosphorus monofluoride 3ΣC∞v
169 PCl phosphorus chloride 3ΣC∞v
170 FO Oxygen monofluoride 2ΠC∞v
171 ClO Monochlorine monoxide 2ΠC∞v
172 SF Monosulfur monofluoride 2ΠC∞v
173 SCl sulfur monochloride 2ΠC∞v
174 F2 Fluorine diatomic 1ΣgD∞h
175 ClF Chlorine monofluoride 1Σ+C∞v
176 Cl2 Chlorine diatomic 1ΣgD∞h
177 HCF Fluoromethylene 1A'Cs
178 HOF Hypofluorous acid 1A'Cs
179 DOCl Hypochlorous acid-d 1A'Cs
180 HOCl hypochlorous acid 1A'Cs
181 CH3F Methyl fluoride 1A1C3v
182 CH3Cl Methyl chloride 1A1C3v
183 SiH3F monofluorosilane 1A1C3v
184 SiH3Cl chlorosilane 1A1C1
185 C3 carbon trimer 1ΣgD∞h
186 C3H3 Propargyl radical 2B1Cs
187 CH2CCH2 allene 1A1D2d
188 CH3CCH propyne 1A'C3v
189 C3H6 Cyclopropane 1A1'D3h
190 CH2CHCH3 Propene 1A'Cs
191 C3H7 n-Propyl radical 2A"C1
192 C3H8 Propane 1A1C2v
193 SiH2(CH3)2 dimethylsilane 1A1C2v
194 HN3 hydrogen azide 1A'Cs
195 CH2NN diazomethane 1A1C2v
196 CH3CN Acetonitrile 1A1C3v
197 CH3NC methyl isocyanide 1A1C3v
198 NHCHNH2 aminomethanimine 1AC1
199 C2H5N Aziridine 1A'C1
200 CH3CH2NH2 Ethylamine 1A'Cs
201 CH3NHCH3 Dimethylamine 1A'Cs
202 BO2 Boron dioxide 2A'D∞h
203 N2O Nitrous oxide 1ΣC∞v
204 CO2 Carbon dioxide 1ΣgD∞h
205 OCS Carbonyl sulfide 1ΣC∞v
206 SiO2 silicon dioxide 1ΣgD∞h
207 CS2 Carbon disulfide 1ΣgD∞h
208 NO2 Nitrogen dioxide 2A1C2v
209 PO2 Phosphorus dioxide 2A1C2v
210 O3 Ozone 1A1Cs
211 SO2 Sulfur dioxide 1A1C2v
212 SSO Disulfur monoxide 1A'Cs
213 S3 Sulfur trimer 1A1C2v
214 HCCO ketenyl radical 2A"Cs
215 HCNO fulminic acid 1ΣC∞v
216 HNCO Isocyanic acid 1A'Cs
217 HOCN cyanic acid 1A'Cs
218 HNO2 Nitrous acid 1A'Cs
219 CH2CO Ketene 1A1C2v
220 HCCOH ethynol 1A'Cs
221 CH2O2 Dioxirane 1A1C2v
222 HCOOH Formic acid 1A'Cs
223 CHONH2 formamide 1A'Planar
224 CH3OO methylperoxy radical 2A"Cs
225 C2H4O Ethylene oxide 1A1C2v
226 CH2CHOH ethenol 1A'Cs
227 CH3CHO Acetaldehyde 1A'Cs
228 C2H4S Thiirane 1A1C2v
229 CH3CHS Thioacetaldehyde 1A'C1
230 CH3OOH Methyl peroxide 1AC1
231 H2OH2CO water formaldehyde dimer 1AC1
232 CH3CH2OH Ethanol 1A'Cs
233 CH3OCH3 Dimethyl ether 1A1C2v
234 CH3CH2SH ethanethiol 1A'Cs
235 CH3SCH3 Dimethyl sulfide 1A1C2v
236 CH3OHH2O methanol water dimer 1A'C1
237 H2OCH3OH water methanol dimer 1AC1
238 FCN Cyanogen fluoride 1ΣC∞v
239 ClCN chlorocyanogen 1ΣC∞v
240 MgCl2 Magnesium dichloride 1ΣgC2v
241 FNO Nitrosyl fluoride 1A'Cs
242 ClNO Nitrosyl chloride 1A'Cs
243 CF2 Difluoromethylene 1A1D∞h
244 CCl2 dichloromethylene 1A1C2v
245 SiCl2 Dichlorosilylene 1A1C2v
246 FOO Dioxygen monofluoride radical 2A"Cs
247 ClOO chloroperoxy radical 2A"Cs
248 OClO Chlorine dioxide 2B1D∞h
249 ClS2 Sulfur chloride 2A"Cs
250 NF2 Difluoroamino radical 2B1C2v
251 F2O Difluorine monoxide 1A1C2v
252 SF2 sulfur difluoride 1A1C2v
253 Cl2O Dichlorine monoxide 1A1C2v
254 SCl2 Sulfur dichloride 1A1C2v
255 HFCO formyl fluoride 1A'Cs
256 BHF2 Difluoroborane 1A1C2v
257 BHCl2 Borane, dichloro- 1A1C2v
258 CH2F2 Methane, difluoro- 1A1C2v
259 CH2FCl fluorochloromethane 1A'Cs
260 CH2Cl2 Methylene chloride 1A1C2v
261 SiH2Cl2 dichlorosilane 1A1C2v
262 CH2CHF Ethene, fluoro- 1A'Cs
263 C2H3Cl Ethene, chloro- 1A'Cs
264 C2H5F fluoroethane 1A'Cs
265 CH3CH2Cl Ethyl chloride 1A'Cs
266 C4 Carbon tetramer 3ΣgD∞h
267 C4H2 Diacetylene 1ΣgD∞h
268 C2H3CCH 1-Buten-3-yne 1A'C1
269 H2CCCCH2 Butatriene 1AgD2h
270 C4H6 1-Methylcyclopropene 1AC1
271 C4H6 Cyclobutene 1A1C2v
272 C4H6 Methylenecyclopropane 1A1C2v
273 CH2CCHCH3 1,2-Butadiene 1A'C1
274 CH2CHCHCH2 1,3-Butadiene 1AgC2h
275 CH3CCCH3 2-Butyne 1A1'D3h
276 CH2C(CH3)CH3 1-Propene, 2-methyl- 1A1C2v
277 CH3CHCHCH3 2-Butene, (E)- 1AgC2h
278 CH3CHCHCH3 2-Butene, (Z)- 1A1C2v
279 Al(CH3)3 trimethyl aluminum 1A'C3h
280 C(CH3)3 Tert-butyl radical 2A"C3v
281 CH2CH(CH3)2 Isobutyl radical 2A'C1
282 CH3CHCH2CH3 2-Butyl radical 1AC1
283 CH3CH(CH3)CH3 Isobutane 1A1C3v
284 CH3CH2CH2CH3 Butane 1AgAnti
285 C2N2 Cyanogen 1ΣgD∞h
286 P4 Phosphorus tetramer 1A1Td
287 HCCCN Cyanoacetylene 1ΣC∞v
288 C3H3N acrylonitrile 1A'Cs
289 C3H7N Cyclopropylamine 1A'C1
290 C4H8 cyclobutane 1A1D2d
291 C2H8N2 Ethylenediamine 1AgC2h
292 CH3CH(NH2)CH3 2-Propanamine 1A'Cs
293 N(CH3)3 Trimethylamine 1A1C3v
294 B2O2 Diboron dioxide 1ΣgD∞h
295 NO3 Nitrogen trioxide 2A1'all bonds equal
296 SO3 Sulfur trioxide 1A1'D3h
297 HNO3 Nitric acid 1A'Cs
298 C2H2O2 Ethanedial 1AgC2h
299 CH3ONO Methyl nitrite 1A'C1
300 C3H4O 2-Propyn-1-ol 1A'Cs
301 C3H4O allenol 1A'Cs
302 C3H4O Cyclopropanone 1A1C2v
303 C3H4O Methylketene 1A'Cs
304 CH2CHCHO Acrolein 1A'Cs
305 NH2CONH2 Urea 1AC2
306 NH2CSNH2 Thiourea 1AC2
307 CH3COOH Acetic acid 1A'Cs
308 CH3OCHO methyl formate 1A'Cs
309 CHOCH2OH hydroxy acetaldehyde 1A'CS H in
310 H2OHCOOH Water formic acid dimer 1 1AC1
311 HCOOHH2O Formic acid water dimer 1AC1
312 CH3CHNOH Acetaldoxime 1A'CS trans
313 CH3CONH2 Acetamide 1A'C1
314 C3H6O Propylene oxide 1AC1
315 CH3CH2CHO Propanal 1A'Cs
316 CH3COCH3 Acetone 1A1C2v
317 C3H6S Thietane 1A'Cs
318 C3H6S Thiirane, methyl- 1AC1
319 CH2SHCH2SH 1,2-Ethanedithiol 1AgC2h
320 CH3SSCH3 Disulfide, dimethyl 1AC2
321 CH3CHOHCH3 Isopropyl alcohol 1AC1
322 C3H7SH 1-Propanethiol 1A'Cs
323 CH3CHSHCH3 2-Propanethiol 1A'Cs
324 CH3SCH2CH3 Ethane, (methylthio)- 1A'Cs
325 H2OCH3OCH3 water dimethylether dimer 1AC1
326 Na2Cl2 Disodium dichloride 1AgC2h
327 C2F2 difluoroacetylene 1ΣgD∞h
328 C2Cl2 dichloroacetylene 1ΣgC2h
329 ClNO2 Nitryl chloride 1A1C2v
330 N2F2 (Z)-Difluorodiazene 1A1C2v
331 N2F2 Dinitrogen difluoride, (E)- 1AgC2h
332 CF2O Carbonic difluoride 1A1C2v
333 CCl2O Phosgene 1A1C2v
334 BF3 Borane, trifluoro- 1A'D3h
335 AlF3 Aluminum trifluoride 1A1'D3h
336 AlF2Cl Aluminum chloride difluoride 1A1C2v
337 AlFCl2 Aluminum dichloride fluoride 1A1C2v
338 BCl3 Borane, trichloro- 1A1'D3h
339 AlCl3 Aluminum trichloride 1A1'D3h
340 CF3 Trifluoromethyl radical 2A1C3v
341 SOCl2 thionyl chloride 1A'Cs
342 NF3 Nitrogen trifluoride 1A1C3v
343 PF3 Phosphorus trifluoride 1A1C3v
344 PCl3 Phosphorus trichloride 1A1C3v
345 ClSSCl Disulfur dichloride 1AC2
346 CHF3 Methane, trifluoro- 1A1C3v
347 CHF2Cl difluorochloromethane 1A'Cs
348 CHFCl2 fluorodichloromethane 1A'Cs
349 CHCl3 Chloroform 1A1C3v
350 SiHCl3 Trichlorosilane 1A1C3v
351 C2H2F2 Ethene, 1,2-difluoro-, (E)- 1AgC2h
352 C2H2F2 Ethene, 1,2-difluoro-, (Z)- 1A1C2v
353 CH2CF2 Ethene, 1,1-difluoro- 1A1C2v
354 CH2CCl2 Ethene, 1,1-dichloro- 1A1C2v
355 CHClCHCl Ethene, 1,2-dichloro-, (E)- 1AgC2h
356 CHClCHCl Ethene, 1,2-dichloro-, (Z)- 1A1C2v
357 CH3COF Acetyl fluoride 1A'NULL
358 CH3COCl Acetyl Chloride 1A'Cs
359 CH3CHF2 Ethane, 1,1-difluoro- 1A'Cs
360 CH3CHFCl Ethane, 1-chloro-1-fluoro- 1AC1
361 CH2ClCH2Cl Ethane, 1,2-dichloro- 1AgC2h
362 CH3CHCl2 Ethane, 1,1-dichloro- 1A'Cs
363 C3H5Cl 1-Propene, 3-chloro- 1AC1
364 C3H5Cl 1-chloro-1-propene(E) 1A'Cs
365 C3H5Cl 1-chloro-1-propene(Z) 1A'Cs
366 C5H6 1,3-Cyclopentadiene 1A1C2v
367 C5H6 1-Buten-3-yne, 2-methyl- 1A'Cs
368 C5H6 3-Penten-1-yne, (E)- 1A'Cs
369 C5H6 3-Penten-1-yne, (Z)- 1A'Cs
370 C5H6 Bicyclo[2.1.0]pent-2-ene 1A'Cs
371 C5H6 Cyclopropylacetylene 1A'C1
372 C5H8 1,2-Butadiene, 3-methyl- 1A1C2v
373 C5H8 1,2-Pentadiene 1A'C1
374 C5H8 1,3-Butadiene, 2-methyl- 1A'Cs
375 C5H8 1,3-Pentadiene, (E)- 1A'C1
376 C5H8 1,3-Pentadiene, (Z)- 1A'Cs
377 C5H8 1,4-Pentadiene 1AC2
378 C5H8 2,3-Pentadiene 1AC1
379 C5H8 Cyclobutane, methylene- 1A'Cs
380 C5H8 Cyclopentene 1A'Cs
381 C5H10 1-Butene, 2-methyl- 1AC1
382 C5H10 2-Butene, 2-methyl- 1A'Cs
383 C5H10 2-Pentene, (E)- 1A'Cs
384 C5H10 2-Pentene, (Z)- 1AC1
385 C5H10 Cyclopentane 1AC1
386 C5H10 Cyclopropane, 1,1-dimethyl- 1A1C1
387 CH2CHCH2CH2CH3 1-pentene 1AC1
388 C5H11 2-Methylbut-2-yl radical 1AC1
389 C5H12 Butane, 2-methyl- 1AC1
390 C5H12 Pentane 1A1C2v
391 C5H12 Propane, 2,2-dimethyl- 1A1Td
392 Si(CH3)4 tetramethylsilane 1A1Td
393 N2O3 Dinitrogen trioxide 1A'Cs
394 C3H2N2 Malononitrile 1A1Cs
395 C3H4N2 1H-Imidazole 1A'Cs
396 C3H4N2 1H-Pyrazole 1A'Cs
397 C4H5N (E)-2-Butenenitrile 1A'Cs
398 C4H5N (Z)-2-Butenenitrile 1A'Cs
399 C4H5N Cyclopropanecarbonitrile 1A'Cs
400 C4H5N Pyrrole 1A1C2v
401 C3H6N2 3-Aminopropionitrile 1A'Cs
402 C5H8 Bicyclo[2.1.0]pentane 1A'Cs
403 C5H8 Spiropentane 1A1D2d
404 C4H9N Cyclobutylamine 1A'Cs
405 C4H9N Pyrrolidine 1A'Cs
406 C3H10N2 1,2-Diaminopropane 1AC1
407 C(NH2)H2C(CH3)HCH3 1-Propanamine, 2-methyl- 1AC1
408 C(NH2)H2CH2CH2CH3 1-Butanamine 1A'Cs
409 CH3C(NH2)HCH2CH3 2-Butanamine 1AC1
410 C3O2 Carbon suboxide 1ΣGD∞h
411 H2SO4 Sulfuric acid 1AC1
412 C3H3NO Isoxazole 1A'Cs
413 CH3NO3 Methyl nitrate 1A'Cs
414 C4H4O Furan 1A1C2
415 C4H4S Thiophene 1A1C2v
416 C3H4O2 β–Propiolactone 1A'Cs
417 C3H4O2 2-Propenoic acid 1A'Cs
418 C3H4O2 propanedial 1AC1
419 C3H4O2 propenalol 1A'Cs
420 CH2CHCONH2 Acrylamide 1ACs
421 CH3OCH2CN Methoxyacetonitrile 1AC1
422 CH5N3S Hydrazinecarbothioamide 1AC1
423 H2NCH2COOH Glycine 1A'Cs
424 C4H6O cis-2-butenal 1ACs
425 C4H6O Cyclobutanone 1A1C2v
426 C4H6O Furan, 2,3-dihydro- 1AC1
427 C4H6O Furan, 2,5-dihydro- 1A1Cs
428 CH2CHOCHCH2 Vinyl ether 1A1C2v
429 CHOCHCHCH3 2-Butenal 1A'Cs
430 C4H6S Thiophene, 2,3-dihydro- 1AC1
431 C4H6S Thiophene, 2,5-dihydro- 1A1C2v
432 CH2CHSCHCH2 Divinyl sulfide 1AC2v
433 C2H6N2O Urea, methyl- 1AC1
434 C3H6O2 1,3-Dioxolane 1AC1
435 CH3COOCH3 methyl acetate 1A'Cs
436 C2H6O2S Dimethyl sulfone 1A1C2v
437 CH3SSSCH3 dimethyl trisulfide 1AC2
438 C3H7NO Propanamide 1A'C1
439 C2H3OC2H5 Ethene, ethoxy- 1AC1
440 C4H8O Cyclobutanol 1A'C1
441 CH2C(CH3)OCH3 1-Propene, 2-methoxy- 1AC1
442 CHOCH(CH3)CH3 Propanal, 2-methyl- 1A'Cs
443 CHOCH2CH2CH3 Butanal 1A'Cs
444 C4H8S Thiophene, tetrahydro- 1AC1
445 C3H8O2 1,3-Propanediol 1A1C1
446 C3H8O2 Hydroperoxide, 1-methylethyl 1AC1
447 C3H8O2 Propylene glycol 1AC1
448 C3H8S2 1,3-Propanedithiol 1A1C1
449 C4H10O 1-Propanol, 2-methyl- 1AC1
450 C4H10O 2-Butanol, (.+/-.)- 1AC1
451 C4H10O Ethanol, 1,1-dimethyl- 1AC1
452 C4H10O Ethoxy ethane 1A1C2v
453 C4H10O Propane, 2-methoxy- 1A'Cs
454 C2H5SC2H5 Diethyl sulfide 1A1C2v
455 CH2(SH)CH(CH3)CH3 1-Propanethiol, 2-methyl- 1AC1
456 CH3C(SCH3)HCH3 Propane, 2-(methylthio)- 1AC1
457 CH3CH(SH)CH2CH3 2-Butanethiol 1AC1
458 FNO3 Fluorine nitrate 1A'Cs
459 ClFO3 Perchloryl fluoride 1A1Cs
460 SO2Cl2 Sulfuryl chloride 1A1C2v
461 F3NO Nitrogen trifluoride oxide 1A1C3v
462 F3PO Phosphoryl fluoride 1A1C3v
463 Cl3PO Phosphoryl chloride 1A1C3v
464 CF4 Carbon tetrafluoride 1A1Td
465 CF3Cl Methane, chlorotrifluoro- 1A1C3v
466 SiF4 Silicon tetrafluoride 1A1Td
467 CF2Cl2 difluorodichloromethane 1A1C2v
468 CFCl3 Trichloromonofluoromethane 1A1C3v
469 CCl4 Carbon tetrachloride 1A1Td
470 SiCl4 Silane, tetrachloro- 1A1Td
471 SF4 Sulfur tetrafluoride 1A1C2v
472 C2HF3 Trifluoroethylene 1A'Cs
473 CHClCCl2 Trichloroethylene 1A'Cs
474 HSO3F Fluorosulfonic acid 1AC1
475 CH3CF3 Ethane, 1,1,1-trifluoro- 1A1C3v
476 CH2ClCHCl2 1,1,2-trichloroethane 1AC1
477 CH3CCl3 Ethane, 1,1,1-trichloro- 1A1C3v
478 C3H5ClO Oxirane, (chloromethyl)- 1AC1
479 CH2ClCHClCH3 Propane, 1,2-dichloro- 1AC1
480 CH3CCl2CH3 Propane, 2,2-dichloro- 1A1C2v
481 CH2CClCH2CH3 1-Butene, 2-chloro- 1A'Cs
482 CH2CHCH2CH2Cl 1-Butene, 4-chloro- 1AC1
483 CH2CHCHClCH3 1-Butene, 3-chloro- 1AC1
484 CH3CClCHCH3 2-Butene, 2-chloro-, (E)- 1A'Cs
485 CH3CClCHCH3 2-Butene, 2-chloro-, (Z)- 1A'Cs
486 CHClCHCH2CH3 (E)-1-Chloro-1-butene 1AC1
487 CHClCHCH2CH3 (Z)-1-Chloro-1-butene 1A'Cs
488 CH2ClCH2CH2CH3 Butane, 1-chloro- 1A'Cs
489 CH3CCl(CH3)CH3 Propane, 2-chloro-2-methyl- 1A1C3v
490 CH3CHClCH2CH3 Butane, 2-chloro- 1AC1
491 C6H4 (E)-Hexa-1,5-diyne-3-ene 1AgCs
492 C6H4 (Z)-Hexa-1,5-diyne-3-ene 1A1C2v
493 C6H6 2,4-Hexadiyne 1A1'D3h
494 C6H6 Benzene 1A1gD6h
495 C6H8 (E)-hexa-1,3,5-triene 1AgCs
496 C6H8 (Z)-hexa-1,3,5-triene 1A1C2v
497 C6H8 (Z)-hexa-2,3,4-triene 1A1C2v
498 C6H8 1,4-Cyclohexadiene 1AgC2v
499 C6H8 3-Methylenecyclopentene 1AC1
500 C6H8 Bicyclo[2.1.1]hex-2-ene 1A1C2v
501 C6H8 Bicyclo[2.2.0]hex-1(4)-ene 1AgD2h
502 C6H8 Bicyclo[3.1.0]hex-2-ene 1AC1
503 C6H10 1,3-Hexadiene, (E)- 1A'Cs
504 C6H10 1,3-Hexadiene, (Z)- 1A'Cs
505 C6H10 1,4-Hexadiene, (E)- 1AC1
506 C6H10 1,4-Hexadiene, (Z)- 1AC1
507 C6H10 1-Butyne, 3,3-dimethyl- 1A1C3v
508 C6H10 1-Hexyne 1A'Cs
509 C6H10 2,4-Hexadiene, (E,E)- 1AgC2h
510 C6H10 2,4-Hexadiene, (E,Z)- 1A'Cs
511 C6H10 2,4-Hexadiene, (Z,Z)- 1A'Cs
512 C6H10 2-Hexyne 1A'C1
513 C6H10 cyclohexene 1AC2
514 C6H10 Cyclopentene, 1-methyl- 1AC1
515 C6H10 Cyclopentene, 3-methyl- 1AC1
516 C6H10 Cyclopentene, 4-methyl- 1AC1
517 C6H12 (E)-3-methylpent-2-ene 1AC1
518 C6H12 (Z)-3-methylpent-2-ene 1AC1
519 C6H12 Cyclohexane 1A1gChair
520 C6H12 Cyclopentane, methyl- 1AC1
521 C6H12 Ethylcyclobutane 1AC1
522 C6H14 Butane, 2,2-dimethyl- 1A'C1
523 C6H14 Butane, 2,3-dimethyl- 1AgC2h
524 C6H14 Hexane 1AgC2h
525 C6H14 Pentane, 2-methyl- 1AC1
526 C6H14 Pentane, 3-methyl- 1A'Cs
527 C4N2 2-Butynedinitrile 1ΣgD∞h
528 CH3N5 5-Aminotetrazole 1AC1
529 C4H4N2 1,3-Diazine 1A1C2v
530 C4H4N2 Pyrazine 1AgD2h
531 C4H4N2 Pyridazine 1A1C2v
532 C4H4N2 Succinonitrile 1AgC2h
533 C2H4N4 1H-Tetrazole, 1-methyl- 1A'Cs
534 C2H4N4 1H-Tetrazole, 5-methyl- 1A'C1
535 C2H4N4 2H-Tetrazole, 2-methyl- 1AC1
536 C5H5N Bicyclo[1.1.0]butane-1-carbonitrile 1A'Cs
537 C5H5N Pyridine 1A1C2v
538 C4H6N2 1H-Imidazole, 2-methyl- 1A'Cs
539 C5H7N (E)-2-Pentenenitrile 1A'Cs
540 C5H7N (E)-3-Pentenenitrile 1AC1
541 C5H7N (Z)-2-Pentenenitrile 1AC1
542 C5H7N 1H-Pyrrole, 1-methyl- 1AC1
543 C5H7N Cyclobutanecarbonitrile 1A'Cs
544 C5H9N 1,2,3,6-Tetrahydropyridine 1AC1
545 C5H9N Butanenitrile, 2-methyl- 1AC1
546 C5H9N Pentanenitrile 1A'Cs
547 C5H9N Propanenitrile, 2,2-dimethyl- 1A1C1
548 C5H11N Cyclopentanamine 1A'Cs
549 C5H11N Piperidine 1A'NH axial
550 C4H12N2 1,2-Butanediamine 1AC1
551 C4H12N2 2-Methyl-1,2-propanediamine 1A'C1
552 N2O4 Dinitrogen tetroxide 1AgD2d
553 C2H3NO3 Oxamic acid 1A'H out
554 C4H4O2 2-Oxetanone, 4-methylene- 1AC1
555 C2H4N2O2 Oxalamide 1AgC2h
556 C3H4O2S 2H-Thiete-1,1-dioxide 1A'C1
557 C3H4S3 1,3-Dithiolane-2-thione 1AC1
558 C4H5NO 3-Methylisoxazole 1AC1
559 C4H5NO Isoxazole, 5-methyl- 1AC1
560 C4H5NS 4-Methylthiazole 1AC1
561 C5H6S Thiophene, 2-methyl- 1A'Cs
562 C5H6S Thiophene, 3-methyl- 1A'Cs
563 C4H6O2 2-Propenoic acid, methyl ester 1AC1
564 C4H6OS 2,3-dihydrothiophene-2-ol 1AC1
565 C4H6OS 2,5-dihydrothiophene-3-ol 1AC1
566 C4H6OS 4,5-dihydrothiophene-2-ol 1AC1
567 C4H6OS 4,5-dihydrothiophene-3-ol 1AC1
568 C4H6OS Dihydro-2-(3H)-thiophenone 1AC1
569 C4H6OS Dihydro-3-(2H)-thiophenone 1AC1
570 C4H6OS Vinyl sulfoxide 1A'Cs
571 CH6N4S Carbonothioic dihydrazide 1AC2
572 C2H6N2O2 (E)-Azodioxymethane 1AgC2h
573 C2H6N2O2 Dimethylnitroamine 1AC1
574 C3H6O3 1,3,5-Trioxane 1A1C1
575 C3H6S3 Carbonotrithioic acid, dimethyl ester 1A1C1
576 C2H6O3S Sulfurous acid, dimethyl ester 1A'C1
577 C4H7NO 2-Pyrrolidinone 1AC1
578 C4H7NO Methacrylamide 1AC1
579 C4H7NO Oxazole, 4,5-dihydro-2-methyl- 1A'C1
580 HCONH2CN2H4 formamide aminomethanimine dimer 1AC1
581 CH3CH(CH3)ONO Isopropyl nitrite 1AC1
582 CH3CH(NH2)COOH Alanine 1AC1
583 CH3NHCH2COOH Sarcosine 1AC1
584 NH2CH2CH2COOH β–alanine 1AC1
585 NH2COOC2H5 Urethane 1AC1
586 C5H8O 2H-Pyran, 3,4-dihydro- 1AC1
587 C5H8O Furan, 2,3-dihydro-5-methyl- 1AC1
588 N(CH3)2CONH2 Urea, N,N-dimethyl- 1AC1
589 NH2CONHC2H5 Urea, ethyl- 1AC1
590 C4H8O2 1,3-Dioxolane, 2-methyl- 1AC1
591 C4H8O2 1,4-Dioxane 1AgC2h
592 C4H8O2 Ethene, 1,1-dimethoxy- 1A1C2v
593 C4H8OS s-Ethyl thioacetate 1AC1
594 C3H8O3 1,2,3-Propanetriol 1AC1
595 C3H8O2S (Methylsulfonyl)ethane 1AC1
596 C4H9NO Butanamide 1AC1
597 C4H9NO Propanamide, 2-methyl- 1AC1
598 C5H10O 2-Butanone, 3-methyl- 1AC1
599 C5H10O 2H-Pyran, tetrahydro- 1A'C1
600 C5H10O 2-Pentanone 1AC1
601 C5H10O 3-Pentanone 1A1C2v
602 C5H10O Cyclopentanol 1AC1
603 C5H10O Oxetane, 3,3-dimethyl- 1A'Cs
604 C5H10O Pentanal 1A'C1
605 C5H10S 2H-Thiopyran, tetrahydro- 1A'Cs
606 C5H10S 3-Ethylthio-1-propene 1A'C1
607 C5H10S Cyclopentanethiol 1AC1
608 C5H10S Thiophene, tetrahydro-2-methyl- 1AC1
609 C5H10S Thiophene, tetrahydro-3-methyl- 1AC1
610 C4H10O2 1,1-Dimethoxyethane 1A'Cs
611 C4H10O2 1,3-Butanediol 1AC1
612 C4H10O2 1,4-Butanediol 1AgC2h
613 C4H10O2 Ethane, 1,2-dimethoxy- 1AgC2h
614 C4H10S2 1,4-Butanedithiol 1AgC2h
615 C4H11NO Diethylhydroxylamine 1A'Cs
616 C5H12O 1-Butanol, 2-methyl- 1AC1
617 C5H12O 1-Butanol, 3-methyl- 1A'Cs
618 C5H12O 1-Pentanol 1A'Cs
619 C5H12O 2-Butanol, 3-methyl- 1AC1
620 C5H12O 2-Pentanol 1AC1
621 C5H12O Butane, 1-methoxy- 1A'Cs
622 C5H12O Propane, 1-ethoxy- 1A'Cs
623 C5H12O Propane, 2-methoxy-2-methyl- 1A'C1
624 C5H12S 1-Butanethiol, 2-methyl- 1AC1
625 C5H12S 1-Butanethiol, 3-methyl- 1A'C1
626 C5H12S 1-Pentanethiol 1A'C1
627 C5H12S 1-Propanethiol, 2,2-dimethyl- 1A'C1
628 C5H12S 2-Butanethiol, 3-methyl- 1AC1
629 C5H12S Butane, 1-(methylthio)- 1A'Cs
630 C5H12S Ethyl propyl sulfide 1A'Cs
631 C5H12S Propane, 2-(ethylthio)- 1A'C1
632 C5H12S Propane, 2-methyl-2-(methylthio)- 1A'C1
633 CF3CN Acetonitrile, trifluoro- 1A1C3v
634 B2F4 Diboron tetrafluoride 1AGD2h
635 B2Cl4 Diboron tetrachloride 1A1D2
636 C2F4 Tetrafluoroethylene 1AgD2h
637 C2Cl4 Tetrachloroethylene 1AgD2h
638 PF5 Phosphorus pentafluoride 1A1'D3h
639 PCl5 Phosphorus pentachloride 1A1'C4v
640 C3H5ClO2 Carbonochloridic acid, ethyl ester 1AC1
641 C3H5Cl3 Propane, 1,2,3-trichloro- 1A'Cs
642 C4H8Cl2 1,4-Dichlorobutane 1AgC2h
643 C4H8Cl2 Butane, 1,2-dichloro- 1AC1
644 C4H8Cl2 Butane, 1,3-dichloro- 1AC1
645 C4H8Cl2 Butane, 2,3-dichloro-, (r*,s*)- 1AgCi
646 C4H9ClO 1-Chloro-2-ethoxyethane 1A'Cs
647 C5H11Cl Pentane, 1-chloro- 1A'Cs
648 C6H5CH2 benzyl radical 2B1Cs
649 C6H5CH3 toluene 1A'Cs
650 C7H12 Norbornane 1A1C2v
651 C7H16 2-methylhexane 1AC1
652 C7H16 heptane 1A1C2v
653 C6H5NH2 aniline 1A'Cs
654 C5H5NO 2(1H)-Pyridinone 1A'Cs
655 C5H5NO 2(3H)-Pyridinone 1ACs
656 C5H5NO 2(5H)-Pyridinone 1A'Cs
657 C5H5NO 2-Pyridinol 1A'Cs
658 C5H5NO 3(2H)-Pyridinone 1A'Cs
659 C5H5NO 3(4H)-Pyridinone 1A'C1
660 C5H5NO 3(6H)-Pyridinone 1A'Cs
661 C5H5NO 3-Pyridinol 1A'Cs
662 C5H5NO 4(1H)-Pryidinone 1A'Cs
663 C5H5NO 4(3H)-Pryidinone 1A'Cs
664 C5H5NO 4-Pyridinol 1A'Cs
665 C6H5OH phenol 1A'Cs
666 C6H6O 2,4-Cyclohexadienone 1ACs
667 C6H10O cyclohexanone 1A'Cs
668 SF6 Sulfur Hexafluoride 1A1GOh
669 C6H5F Fluorobenzene 1A1C2v
670 C6H5Cl chlorobenzene 1A1C2v
671 C6H5CCH phenylacetylene 1A1C2v
672 C6H5CHCH2 Styrene 1A'Cs
673 C8H8 cubane 1A1GOh
674 C8H8 cyclooctatetraene 1A1D2d
675 C6H5CH2CH3 Ethylbenzene 1A'Cs
676 S8 Octasulfur 1A1D4d
677 C6H5CHO benzaldehyde 1A'Cs
678 C6H5OCH3 Anisole 1A'Cs
679 C2F6 hexafluoroethane 1A1gD3d
680 C8H7N Indole 1A'Cs
681 C6H5NO2 Nitrobenzene 1A1C2v
682 C6H5COOH benzoic acid 1A'Cs
683 C10H8 naphthalene 1AgD2h
684 C10H16 adamantane 1A1Td
685 C12H10 biphenyl 1AD2

Species NOT done yet
count Species Name file name problem
1 D- Deuterium atom anion d-  
2 D+ Deuterium atom cation d+  
3 H- Hydrogen atom anion h-  
4 H2- hydrogen diatomic anion h2-  
5 H2+ Hydrogen cation h2+  
6 H3+ hydrogen trimer cation h3+  
7 He Helium atom he  
8 He- Helium atom anion he-  
9 He+ Helium atom cation he+  
10 HeH Helium hydride heh  
11 HeH+ Helium hydride cation heh+  
12 He2+ helium diatomic cation he2+  
13 Li- Lithium atom anion li-  
14 Li+ Lithium atom cation li+  
15 Na- Sodium atom anion na-  
16 Na+ Sodium atom cation na+  
17 K Potassium atom k  
18 K- Potassium atom anion k-  
19 K+ Potassium atom cation k+  
20 Cu Copper atom cu  
21 Cu- Copper atom anion cu-  
22 Cu+ Copper atom cation cu+  
23 LiH- lithium hydride anion lih-  
24 LiH+ lithium hydride cation lih+  
25 NaH- sodium hydride anion nah-  
26 NaH+ sodium hydride cation nah+  
27 KH Potassium hydride kh  
28 KH+ Potassium hydrogen cation kh+  
29 CuH Copper monohydride cuh  
30 Be- Beryllium atom anion be-  
31 Mg- Magnesium atom anion mg-  
32 Ca Calcium atom ca  
33 Ca- Calcium atom anion ca-  
34 Ca+ Calcium atom cation ca+  
35 Zn Zinc atom zn  
36 Zn- Zinc atom anion zn-  
37 Zn+ Zinc atom cation zn+  
38 BeH- berylium monohydride anion beh-  
39 BeH+ beryllium monohydride cation beh+  
40 MgH- magnesium monohydride anion mgh-  
41 MgH+ magnesium monohydride cation mgh+  
42 CaH Calcium monohydride cah  
43 CaH+ Calcium monohydride cation cah+  
44 TiH Titanium monohydride tih  
45 ZnH Zinc monohydride znh  
46 ZnH+ Zinc, protonated znh+  
47 BeH2+ Beryllium dihydride cation beh2+  
48 CaH2 Calcium Hydride cah2  
49 ZnH2 Zinc hydride znh2  
50 B- Boron atom anion b-  
51 Al- Aluminum atom anion al-  
52 Sc Scandium atom sc  
53 Sc+ Scandium cation sc+  
54 Ga Gallium atom ga  
55 Ga- Gallium atom anion ga-  
56 Ga+ Gallium atom cation ga+  
57 BH- boron monohydride anion bh-  
58 BH+ boron monohydride cation bh+  
59 AlH- aluminum monohydride anion alh-  
60 AlH+ aluminum monohydride cation alh+  
61 ScH Scandium monohydride sch  
62 ScH+ Scandium monohydride cation sch+  
63 GaH Gallium monohydride gah  
64 GaH+ Gallium monohydride cation gah+  
65 BH2- boron dihydride anion bh2-  
66 BH2+ Boron dihydride cation bh2+  
67 AlH2- aluminum dihydride anion alh2-  
68 AlH2+ aluminum dihydride cation alh2+  
69 BH3- boron trihydride anion bh3-  
70 BH3+ boron trihydride cation bh3+  
71 AlH3- aluminum trihydride anion alh3-  
72 AlH3+ aluminum trihydride cation alh3+  
73 ScH3 Scandium trihydride sch3  
74 GaH3 Gallium trihydride gah3  
75 BH4 borohydride bh4  
76 BH4- borohydride anion bh4-  
77 AlH4- Aluminum tetrahydride anion alh4-  
78 C- Carbon atom anion c-  
79 Si- Silicon atom anion si-  
80 Ti Titanium atom ti  
81 Ti- Titanium atom anion ti-  
82 Ti+ Titanium atom cation ti+  
83 Ge Germanium atom ge  
84 Ge- Germanium anion ge-  
85 Ge+ Germanium cation ge+  
86 Sn Tin atom sn  
87 Sn+ Tin cation sn+  
88 CH- methylidyne anion ch-  
89 CH+ Methylidyne cation ch+  
90 SiH- silicon monohydride anion sih-  
91 SiH+ silicon monohydride cation sih+  
92 GeH germylidene geh  
93 GeH+ Germaniun monohyrdide cation geh+  
94 CH2- methylene anion ch2-  
95 CH2+ methylene cation ch2+  
96 SiH2- silicon dihydride anion sih2-  
97 SiH2+ silicon dihydride cation sih2+  
98 GeH2 germylene geh2  
99 GeH2- germylene anion geh2-  
100 CH3- methyl anion ch3-  
101 CH3+ methyl cation ch3+  
102 SiH3- Silyl anion sih3-  
103 SiH3+ Silyl cation sih3+  
104 GeH3 Germyl radical geh3  
105 GeH3+ germyl cation geh3+  
106 CD4 methane-d4 cd4  
107 CH2D2 methane-d2 ch2d2  
108 CH3D methane-d ch3d  
109 CH4- Methane anion ch4-  
110 CH4+ Methane cation ch4+  
111 CHD3 methane-d3 chd3  
112 SiH2D2 silane-d2 sih2d2  
113 SiH4+ Silane cation sih4+  
114 GeH4 Germane geh4  
115 SnH4 Stannane snh4  
116 SiH5+ Silane, protonated sih5+  
117 N Nitrogen atom n  
118 N- Nitrogen atom anion n-  
119 P- Phosphorus atom anion p-  
120 P+ Phosphorus atom cation p+  
121 V Vanadium atom v  
122 V+ Vanadium atom cation v+  
123 As Arsenic atomic as  
124 As- Arsenic anion as-  
125 As+ Arsenic cation as+  
126 Sb Antimony atom sb  
127 NH- Imidogen anion nh-  
128 NH+ imidogen cation nh+  
129 PH- phosphorus monohydride anion ph-  
130 PH+ phosphorus monohydride cation ph+  
131 AsH Arsenic monohydride ash  
132 AsH+ Arsenic monohydride cation ash+  
133 SbH Antimony monohydride sbh  
134 NH2- amino anion nh2-  
135 NH2+ Amino cation nh2+  
136 PH2- Phosphino anion ph2-  
137 PH2+ Phosphino cation ph2+  
138 AsH2 Arsenic dihydride ash2  
139 AsH2+ Arsenic dihydride cation ash2+  
140 NH3- Ammonia anion nh3-  
141 NH3+ ammonia cation nh3+  
142 PH3+ Phosphine cation ph3+  
143 AsH3 Arsine ash3  
144 AsH3+ Arsine cation ash3+  
145 SbH3 Stibine sbh3  
146 AsH4+ Arsonium ash4+  
147 NH4 Ammonium radical nh4  
148 NH4+ ammonium cation nh4+  
149 PH4 Phosphoranyl radical ph4  
150 PH4+ phosphonium cation ph4+  
151 O- Oxygen atom anion o-  
152 S- Sulfur atom anion s-  
153 S+ Sulfur atom cation s+  
154 Cr Chromium atom cr  
155 Se Selenium atom se  
156 Se- Selenium atom anion se-  
157 Se+ Selenium atom cation se+  
158 Te Tellurium atom te  
159 Te+ Tellurium atom cation te+  
160 OH- hydroxide anion oh-  
161 OH+ hydoxyl cation oh+  
162 HS- mercapto anion sh-  
163 HS+ sulfur monohydride cation sh+  
164 CrH Chromium hydride crh  
165 CrH+ Chromium hydride cation crh+  
166 HSe Selenium monohydride hse  
167 HSe- selenium monohydride anion hse-  
168 HSe+ selenium monohydride cation hse+  
169 TeH Telluryl radical teh  
170 H2O- water anion h2o-  
171 H2O+ water cation h2o+  
172 H2S- Hydrogen sulfide anion h2s-  
173 H2S+ Hydrogen sulfide cation h2s+  
174 H2Se Hydrogen selenide h2se  
175 H2Se+ Hydrogen selenide cation h2se+  
176 H2Te Hydrogen Telluride h2te  
177 H3O+ hydronium cation h3o+  
178 H3S+ Sulfonium cation h3s+  
179 H3Se+ Hydrogen Selenide, protonated h3se+  
180 F- Fluorine atom anion f-  
181 Cl- Chlorine atom anion cl-  
182 Mn Manganese atom mn  
183 Br Bromine atom br  
184 Br- Bromine atom anion br-  
185 Br+ Bromine atom cation br+  
186 I Iodine atom iodine  
187 I- Iodine atom anion iodine-  
188 I+ Iodine atom cation iodine+  
189 HF- hydrogen fluoride anion hf-  
190 HF+ hydrogen fluoride cation hf+  
191 HCl- hydrogen chloride anion hcl-  
192 HCl+ hydrogen chloride cation hcl+  
193 HBr hydrogen bromide hbr  
194 HBr- hydrogen bromide anion hbr-  
195 HBr+ hydrogen bromide cation hbr+  
196 HI Hydrogen iodide hi  
197 HI+ Hydrogen iodide cation hi+  
198 H2F+ dihydrogen fluoride cation h2f+  
199 H2Cl+ dihydrogen monochloride cation h2cl+  
200 H2Br+ protonated hydrogen bromide h2br+  
201 H2I+ Iodonium h2i+  
202 Ne Neon atom ne  
203 Ne- Neon atom anion ne-  
204 Ne+ Neon atom cation ne+  
205 Ar Argon atom ar  
206 Ar- Argon atom anion ar-  
207 Ar+ Argon atom cation ar+  
208 Fe Iron atom fe  
209 Kr Krypton atom kr  
210 Kr+ Krypton cation kr+  
211 Xe Xenon atom xe  
212 HeLi+ Helium Lithium cation heli+  
213 NeH neon hydrogen neh  
214 NeH+ neon hydrogen cation neh+  
215 ArH+ Argon hydride cation arh+  
216 KrH+ Protonated Krypton krh+  
217 XeH+ Xenon, protonated xeh+  
218 H2Ar H2 Ar dimer h2ar  
219 Co Cobalt atom cobalt  
220 Ni Nickel atom ni  
221 Li2- lithium diatomic anion li2-  
222 Li2+ lithium diatomic cation li2+  
223 NaLi- lithium sodium anion lina-  
224 NaLi+ lithium sodium cation lina+  
225 LiK Lithium Potassium lik  
226 Na2- sodium diatomic anion na2-  
227 Na2+ sodium diatomic cation na2+  
228 NaK Sodium Potassium nak  
229 NaK+ Sodium Potassium diatomic cation nak+  
230 K2 Potassium diatomic k2  
231 Cu2 Copper diatomic cu2  
232 LiBe Lithium Beryllium libe  
233 LiMg Lithium magnesium limg  
234 NaBe Sodium Beryllium nabe  
235 NaMg Sodium Magnesium namg  
236 Be2 Beryllium diatomic be2  
237 Be2- Beryllium diatomic anion be2-  
238 Be2+ Beryllium diatomic cation be2+  
239 BeMg Beryllium Magnesium bemg  
240 Mg2- magnesium diatomic anion mg2-  
241 Mg2+ magnesium diatomic cation mg2+  
242 Ca2 Calcium diatomic ca2  
243 LiB Lithium boride lib  
244 LiAl Lithium Aluminum lial  
245 NaAl Sodium aluminum naal  
246 BeB Beryllium monoboride beb  
247 B2- Boron diatomic anion b2-  
248 B2+ Boron diatomic cation b2+  
249 BAl Boron Aluminum bal  
250 Al2- aluminum diatomic anion al2-  
251 Al2+ aluminum diatomic cation al2+  
252 BGa Boron Gallium bga  
253 AlGa Aluminum Gallium alga  
254 Ga2 Gallium diatomic ga2  
255 HBBH Diborane(2) hbbh  
256 LiBH4 Lithium borohydride libh4  
257 B2H4 Diborane(4) D2d b2h4  
258 HBHHBH Diborane(4) C2V hbhhbh  
259 B2H6+ Diborane cation b2h6  
260 Al2H6 dialane al2h6  
261 Ga2H6 digallane ga2h6  
262 LiC Lithium Carbide lic  
263 BeC Beryllium Carbide bec  
264 CaC Calcium monocarbide cac  
265 BC boron monocarbide bc  
266 BC- boron monocarbide anion bc-  
267 BC+ boron monocarbide cation bc+  
268 AlC Aluminum carbide alc  
269 BSi Boron silicide bsi  
270 C2- carbon diatomic anion c2-  
271 C2+ carbon diatomic cation c2+  
272 SiC silicon monocarbide sic  
273 SiC- silicon monocarbide anion sic-  
274 SiC+ silicon monocarbide cation sic+  
275 Si2- silcon diatomic anion si2-  
276 Si2+ silcon diatomic cation si2+  
277 GeC Germanium monocarbide gec  
278 SiGe Silicon Germanium sige  
279 Ge2 Germanium diatomic ge2  
280 C2H- Ethynyl anion c2h-  
281 C2H+ Ethynyl cation c2h+  
282 ZnCH2 Zinc methylene znch2  
283 C2H2+ acetylene cation c2h2+  
284 H2CC- vinylidene anion h2cc-  
285 HCCH- acetylene anion c2h2-  
286 Si2H2 disilyne si2h2  
287 CH3Li methyl lithium ch3li  
288 CuCH3 monomethyl copper cuch3  
289 ZnCH3 Zinc monomethyl znch3  
290 CH2BH methyleneborane ch2bh  
291 C2H3- vinyl anion c2h3-  
292 C2H3+ vinyl cation c2h3+  
293 C2H4- Ethylene anion c2h4-  
294 C2H4+ Ethylene cation c2h4+  
295 CH3CH methylmethylene ch3ch  
296 CH2SiH2 silaethylene ch2sih2  
297 Si2H4 Disilene si2h4  
298 CH3BH2 methylborane ch3bh2  
299 C2H5- Ethyl anion c2h5-  
300 C2H5+ Ethyl cation c2h5+  
301 C2H6+ ethane cation c2h6+  
302 GeH3CH3 methyl germane geh3ch3  
303 C2H7+ Ethane, protonated c2h7+  
304 LiN Lithium Nitride lin  
305 LiN+ Lithium Nitride cation lin+  
306 LiP Lithium monophosphide lip  
307 BeN Beryllium mononitride ben  
308 BeN- Beryllium mononitride anion ben-  
309 BeN+ Beryllium mononitride cation ben+  
310 MgN Magnesium Nitride mgn  
311 BN- boron nitride anion bn-  
312 AlN- aluminum mononitride anion aln-  
313 AlN+ aluminum mononitride cation aln+  
314 BP Boron monophosphide bp  
315 AlP Aluminum monophosphide alp  
316 GaN Gallium mononitride gan  
317 GaP Gallium monophosphide gap  
318 GaAs Gallium arsenide gaas  
319 BN+ boron nitride cation bn+  
320 CN- cyanide anion cn-  
321 CN+ Cyano cation cn+  
322 CP Carbon monophosphide cp  
323 CP- carbon monophosphide anion cp-  
324 CP+ carbon monophosphide cation cp+  
325 SiN- silicon mononitride anion sin-  
326 SiN+ silicon mononitride cation sin+  
327 SiP Silicon monophosphide sip  
328 SiP- Silicon monophosphide anion sip-  
329 SiP+ Silicon monophosphide cation sip+  
330 TiN Titanium mononitride tin  
331 N2- nitrogen diatomic anion n2-  
332 N2+ diatomic nitrogen cation n2+  
333 PN- phosphorus nitride anion pn-  
334 PN+ phosphorus nitride cation pn+  
335 P2- phosphorus diatomic anion p2-  
336 P2+ phosphorus diatomic cation p2+  
337 AsN Arsenic mononitride asn  
338 AsP Arsenic monophosphide asp  
339 SbN Antimony nitride sbn  
340 As2 Arsenic diatomic as2  
341 HNB hydrogen nitrogen boron hnb  
342 HCN- Hydrogen cyanide anion hcn-  
343 HCN+ hydrogen cyanide cation hcn+  
344 HNC+ hydrogen isocyanide cation hnc+  
345 HCP+ Phosphaethyne cation hcp+  
346 NNH+ Dinitrogen monohydride cation nnh+  
347 HPO+ Hydrogen phosphorus oxide cation hpo+  
348 LiNH2 lithium amide linh2  
349 HBNH Boranimine hbnh  
350 CNH2 Aminomethylidyne radical cnh2  
351 CNH2+ N-protonated hydrogen isocyanide cnh2+  
352 H2CN Dihydrogen cyanide radical h2cn  
353 H2CN+ hydrocyanonium cation h2cn+  
354 HCNH methyleneazane hcnh  
355 HCNH+ N-protonated HCN hcnh+  
356 H2NN Isodiazene h2nn  
357 N2H2 (Z)-Diazene n2h2z  
358 N2H2+ trans-diazene cation n2h2+  
359 CH2NH+ Methanimine cation ch2nh+  
360 CHNH2 aminomethylene chnh2  
361 CHNH2+ Aminocarbene cation chnh2+  
362 BH2NH2 Boranamine bh2nh2  
363 CH2NH2+ methyleneamine cation ch2nh2+  
364 N2H4+ hydrazine cation n2h4+  
365 CH3NH2+ methyl amine cation ch3nh2+  
366 SiH3NH2 Silane, amino sih3nh2  
367 N2H5+ protonated hydrazine n2h5+  
368 BH3PH3 borane phosphine bh3ph3  
369 BH3NH3 borane ammonia bh3nh3  
370 CH3NH3 methyl ammonium radical ch3nh3  
371 CH3NH3+ protonated methylamine ch3nh3+  
372 CH3PH3+ methyl phosphine, protonated ch3ph3+  
373 N2H7+ ammonia ammonium dimer n2h7+  
374 LiO- lithium oxide anion lio-  
375 LiO+ lithium oxide cation lio+  
376 LiS Lithium monosulfide lis  
377 LiS+ Lithium sulfide cation lis+  
378 NaO- sodium oxide anion nao-  
379 NaO+ sodium oxide cation nao+  
380 KO Potassium monoxide ko  
381 KO+ Potassium monoxide cation ko+  
382 NaS Sodium sulfide nas  
383 CuO Copper Monoxide cuo  
384 LiSe Lithium monoselenide lise  
385 BeO- Beryllium monoxide anion beo-  
386 BeO+ Beryllium monoxide cation beo+  
387 BeS beryllium sulfide bes  
388 MgO- magnesium oxide anion mgo-  
389 MgO+ magnesium oxide cation mgo+  
390 CaO Calcium monoxide cao  
391 MgS- magnesium sulfide anion mgs-  
392 MgS+ magnesium sulfide cation mgs+  
393 CaS Calcium sulfide cas  
394 ZnO zinc monoxide zno  
395 ZnS Zinc sulfide zns  
396 BeS- Beryllium monosulfide anion bes-  
397 BeS+ Beryllium monosulfide cation bes+  
398 BO- boron monoxide anion bo-  
399 AlO- Aluminum monoxide anion alo-  
400 AlO+ aluminum monoxide cation alo+  
401 BS boron sulfide bs  
402 BS- boron monosulfide anion bs-  
403 BS+ boron monosulfide cation bs+  
404 AlS- aluminum monosulfide anion als-  
405 AlS+ aluminum monosulfide cation als+  
406 ScO Scandium monoxide sco  
407 GaO Gallium monoxide gao  
408 GaS Gallium monosulfide gas  
409 BO+ boron monoxide cation bo+  
410 CO- carbon monoxide anion co-  
411 CO+ carbon monoxide cation co+  
412 CS- carbon monosulfide anion cs-  
413 CS+ carbon monosulfide cation cs+  
414 SiO- silicon monoxide anion sio-  
415 SiO+ silicon monoxide cation sio+  
416 SiS- silicon monosulfide anion sis-  
417 SiS+ silicon monosulfide cation sis+  
418 TiO Titanium monoxide tio  
419 CSe Carbon monoselenide cse  
420 CSe- Carbon monoselenide anion cse-  
421 CSe+ Carbon monoselenide cation cse+  
422 GeO Germanium monoxide geo  
423 GeO+ Germanium monoxide cation geo+  
424 GeS Germanium monosulfide ges  
425 SiSe Silicon Monoselenide sise  
426 SiSe+ Silicon Monoselenide cation sise+  
427 GeSe Germanium monoselenide gese  
428 NO- nitric oxide anion no-  
429 NO+ nitric oxide cation no+  
430 NS- nitrogen sulfide anion ns-  
431 NS+ nitrogen sulfide cation ns+  
432 PO- phosphorus monoxide anion po-  
433 PO+ phosphorus monoxide cation po+  
434 PS- phosphorus monosulfide anion ps-  
435 PS+ phosphorus monosulfide cation ps+  
436 VO Vanadium monoxide vo  
437 AsO Arsenic monoxide aso  
438 NSe Nitrogen monoselenide nse  
439 AsS Arsenic monosulfide ass  
440 PSe Phosphorus monoselenide pse  
441 AsSe Arsenic monoselenide asse  
442 O2- oxygen diatomic anion o2-  
443 O2-- dioxygen dianion o2--  
444 SO- sulfur monoxide anion so-  
445 SO+ sulfur monoxide cation so+  
446 S2- sulfur diatomic anion s2-  
447 S2+ sulfur diatomic cation s2+  
448 SeO Selenium monoxide seo  
449 SeO- selenium monoxide anion seo-  
450 SeO+ selenium monoxide cation seo+  
451 SeS Selenium monosulfide ses  
452 SeS- selenium monosulfide anion ses-  
453 SeS+ selenium monosulfide cation ses+  
454 TeO Tellurium monoxide teo  
455 Se2 Selenium diatomic se2  
456 Se2- selenium diatomic anion se2-  
457 Se2+ selenium diatomic cation se2+  
458 Te2 Tellurium diatomic te2  
459 KOH Potassium hydroxide koh  
460 CaOH Calcium monohydroxide caoh  
461 COH Hydroxymethylidyne coh  
462 COH+ Carbon Monoxide, protonated coh+  
463 HCO- formyl anion hco-  
464 HCO+ Formyl cation hco+  
465 HCS- Thioformyl anion hcs-  
466 HCS+ Thioformyl cation hcs+  
467 HNO- Nitrosyl hydride anion hno-  
468 HNO+ Nitrosyl hydride cation hno+  
469 NOH Hydroxyimidogen noh  
470 NOH+ O-protonated nitric oxide noh+  
471 HNS Sulfur imide hns  
472 HNS- Sulfur imide anion hns-  
473 HO2- Hydroperoxy anion ho2-  
474 HO2+ Hydroperoxy cation ho2+  
475 HSO+ Sulfur Monoxide, S-protonated HSO+  
476 SOH Sulfur Hydroxide soh  
477 SOH+ Sulfur Monoxide, protonated soh+  
478 HS2 Thiosulfeno radical hs2  
479 H2CO- formaldehyde anion h2co-  
480 H2CO+ formaldehyde cation h2co+  
481 HOCH hydroxycarbene hoch  
482 H2CS- thioformaldehyde anion h2cs-  
483 H2CS+ thioformaldehyde cation h2cs+  
484 H2CSe Selenoformaldehyde h2cse  
485 H2NO nitroxide h2no  
486 H2O2+ Hydrogen peroxide cation h2o2+  
487 H2OO water oxide h2oo  
488 HOSH hydrogen thioperoxide hosh  
489 H2S2+ hydrogen disulfide cation h2s2+  
490 H2Se2 hydrogen diselenide h2se2  
491 CH2OH+ hydroxymethyl cation ch2oh+  
492 CH3O- methoxy anion ch3o-  
493 CH3O+ Methoxy cation ch3o+  
494 H2CSH+ Thioformaldehyde, protonated h2csh+  
495 NH2OH+ Hydroxylamine cation nh2oh+  
496 NH3O Ammonia Oxide nh3o  
497 H2POH Phosphinous acid h2poh  
498 H3PO Phosphine oxide h3po  
499 NH2SH Thiohydroxylamine nh2sh  
500 NH3S sulfidoazane nh3s  
501 H3O2+ hydrogen peroxide, protonated h3o2+  
502 CH3OH- Methyl alcohol anion ch3oh-  
503 CH3OH+ Methyl alcohol cation ch3oh+  
504 CH3SH+ Methanethiol cation ch3sh+  
505 SiH3OH silanol sih3oh  
506 CH3SeH Methane selenol ch3seh  
507 NH2OH2+ protonated hydroxylamine nh2oh2+  
508 NH3OH+ N-protonated hydroxylamine nh3oh+  
509 CH3OH2+ Methanol, protonated ch3oh2+  
510 CH3SH2+ protonated methylsulfide ch3sh2+  
511 H2ONH3 Water Ammonia Dimer h2onh3  
512 H5O2+ Dihydroxonium ion h5o2+  
513 LiCl- lithium chloride anion licl-  
514 LiCl+ lithium chloride cation licl+  
515 NaF- sodium fluoride anion naf-  
516 NaF+ sodium fluoride cation naf+  
517 KF Potassium Fluoride kf  
518 NaCl- sodium chloride anion nacl-  
519 NaCl+ sodium chloride cation nacl+  
520 KCl Potassium Chloride kcl  
521 CuF Copper monofluoride cuf  
522 LiBr Lithium Bromide libr  
523 LiBr- lithium bromide anion libr-  
524 LiBr+ lithium bromide cation libr+  
525 CuCl Copper monochloride cucl  
526 NaBr Sodium Bromide nabr  
527 NaBr- sodium bromide anion nabr-  
528 NaBr+ sodium bromide cation nabr+  
529 KBr Potassium Bromide kbr  
530 LiI Lithium Iodide lii  
531 NaI Sodium Iodide nai  
532 KI Potassium Iodide ki  
533 LiF- lithium fluoride anion lif-  
534 LiF+ lithium fluoride cation lif+  
535 BeF- Beryllium monofluoride anion bef-  
536 BeF+ Beryllium monofluoride cation bef+  
537 MgF- magnesium fluoride anion mgf-  
538 MgF+ magnesium fluoride cation mgf+  
539 CaF Calcium monofluoride caf  
540 MgCl- magnesium monochloride anion mgcl-  
541 MgCl+ magnesium monochloride cation mgcl+  
542 CaCl calcium monochloride cacl  
543 TiCl Titanium Monochloride ticl  
544 ZnF Zinc monofluoride znf  
545 ZnF- Zinc monofluoride anion znf-  
546 ZnF+ Zinc monofluoride cation znf+  
547 ZnCl Zinc monochloride zncl  
548 CaBr Calcium monobromide cabr  
549 BeCl- beryllium monochloride anion becl-  
550 BeCl+ beryllium monochloride cation becl+  
551 BF- Boron monofluoride anion bf-  
552 BF+ Boron monofluoride cation bf+  
553 AlF- Aluminum monofluoride anion alf-  
554 AlF+ Aluminum monofluoride cation alf+  
555 BCl- boron monochloride anion bcl-  
556 BCl+ boron monochloride cation bcl+  
557 AlCl Aluminum monochloride alcl  
558 AlCl- aluminum monochloride anion alcl-  
559 AlCl+ aluminum monochloride cation alcl+  
560 ScF Scandium monofluoride scf  
561 BBr Boron monobromide bbr  
562 GaF Gallium monofluoride gaf  
563 GaF+ Gallium monofluoride cation gaf+  
564 AlBr Aluminum monobromide albr  
565 GaCl Gallium monochloride gacl  
566 GaCl+ Gallium monochloride cation gacl+  
567 AlI Aluminum monoiodide ali  
568 GaBr Gallium monobromide gabr  
569 CF- carbon monofluoride anion cf-  
570 CF+ carbon monofluoride cation cf+  
571 CCl- carbon monochloride anion ccl-  
572 CCl+ carbon monochloride cation ccl+  
573 SiF- silicon monofluoride anion sif-  
574 SiF+ silicon monofluoride cation sif+  
575 SiCl Clorosilylidyne sicl  
576 SiCl- silicon monochloride anion sicl-  
577 SiCl+ silicon monochloride cation sicl+  
578 CBr Carbon monobromide cbr  
579 GeF Germanium monofluoride gef  
580 GeF+ Germanium monofluoride cation gef+  
581 GeCl Germanium monochloride gecl  
582 GeCl+ Germanium monochloride cation gecl+  
583 SiBr Silicon monobromide sibr  
584 SiBr+ Silicon monobromide cation sibr+  
585 NF- nitrogen monofluorine anion nf-  
586 NF+ nitrogen monofluoirde cation nf+  
587 NCl nitrogen monochloride ncl  
588 NCl- nitrogen monochloride anion ncl-  
589 NCl+ nitrogen monochloride cation ncl+  
590 PF- phosphorus monofluoride anion pf-  
591 PF+ phosphorus monofluoride cation pf+  
592 PCl- phosphorus monochloride anion pcl-  
593 PCl+ phosphorus monochloride cation pcl+  
594 AsF Arsenic monofluoride asf  
595 NBr nitrogen monobromide nbr  
596 AsCl Arsenic monochloride ascl  
597 PBr Phosphorus monobromide pbr  
598 SbF Antimony monofluoride sbf  
599 SbCl Antimony monochloride sbcl  
600 FO- flourine oxide anion fo-  
601 FO+ fluorine monoxide cation fo+  
602 ClO- chlorine monoxide anion clo-  
603 ClO+ chlorine monoxide cation clo+  
604 SF- sulfur monofluoride anion sf-  
605 SF+ sulfur monofluoride cation sf+  
606 SCl- sulfur monochloride anion scl-  
607 SCl+ sulfur monochloride cation scl+  
608 BrO Bromine monoxide bro  
609 BrO- Bromine monoxide anion bro-  
610 BrO+ Bromine monoxide cation bro+  
611 SeF Selenium monofluoride sef  
612 SBr Sulfur monobromide radical sbr  
613 SBr+ Sulfur monobromide cation sbr+  
614 SeCl Selenium monochloride secl  
615 IO Iodine monoxide io  
616 SeBr Selenium monobromide sebr  
617 BrCl Bromine monochloride brcl  
618 F2- flourine diatomic anion f2-  
619 F2+ flourine diatomic cation f2+  
620 ClF- clorine monofluoride anion clf-  
621 ClF+ clorine monofluoride cation clf+  
622 Cl2- chlorine diatomic anion cl2-  
623 Cl2+ chlorine diatomic cation cl2+  
624 BrF Bromine monofluoride brf  
625 BrF- bromine fluoride anion brf-  
626 BrF+ bromine fluoride cation brf+  
627 BrCl- bromine chloride anion brcl-  
628 BrCl+ bromine chloride cation brcl+  
629 IF Iodine monofluoride if  
630 Br2 Bromine diatomic br2  
631 Br2- bromine diatomic anion br2-  
632 Br2+ bromine diatomic cation br2+  
633 ICl Iodine monochloride icl  
634 IBr Iodine monobromide ibr  
635 I2 Iodine diatomic i2  
636 I2+ Iodine diatomic cation i2+  
637 HCCl Chloromethylene hccl  
638 HSiF fluorosilylene hsif  
639 HSiCl Chlorosilylene hsicl  
640 HSiBr monobromosilylene hsibr  
641 CHBr bromomethylene chbr  
642 HOCl+ hypochlorous acid cation hocl+  
643 HOBr Hypobromous acid hobr  
644 HOBr+ Hypobromous acid cation hobr+  
645 HOI Hypoiodous acid hoi  
646 F2H+ Fluorine, protonated f2h+  
647 FHF Hydrogen difluoride fhf  
648 FHF- Hydrogen difluoride anion fhf-  
649 ClFH+ Chlorine fluoride, F-protonated clfh+  
650 FClH+ Chlorine fluoride, Cl-protonated fclh+  
651 Cl2H+ Chlorine, protonated cl2h+  
652 CH2Br bromomethyl radical ch2br  
653 CH2F fluoromethyl radical ch2f  
654 CH2F+ fluoromethyl cation ch2f+  
655 CH2Cl+ chloromethyl cation ch2cl+  
656 CH2Cl chloromethyl radical ch2cl  
657 NH2F monofluoroamine nh2f  
658 NH2Cl chloramine nh2cl  
659 H2F2 Hydrogen fluoride dimer h2f2  
660 CH3F+ methyl fluoride cation ch3f+  
661 CD3F methylfluoride-d3 cd3f  
662 CD3Cl methyl chloride d3 cd3cl  
663 CH3Cl+ Methyl chloride cation ch3cl+  
664 CH3Br methyl bromide ch3br  
665 GeH3F monofluorogermane geh3f  
666 GeH3Cl monochlorogermane geh3cl  
667 SiH3Br bromosilane sih3br  
668 CH3I methyl iodide ch3i  
669 SiH3I Silyl Iodide sih3i  
670 NH3Cl+ protonated monochloroammonia nh3cl+  
671 CH3ClH+ methyl chloride, protonated ch3clh+  
672 NH4Cl Ammonium chloride nh4cl  
673 LiNe+ Lithium Neon cation line+  
674 Ne2 Neon diatomic ne2  
675 Ne2+ Neon diatomic cation ne2+  
676 Ar2 Argon diatomic ar2  
677 Ar2+ Argon diatomic cation ar2+  
678 Li3 Lithium trimer li3  
679 Li3+ Lithium trimer cation li3+  
680 C3+ carbon trimer cation c3+  
681 SiC2 Silicon dicarbide sic2  
682 C3H3 cyclopropenyl radical cpr  
683 C3H3- Propargyl anion c3h3-  
684 C3H3+ cyclopropenyl cation cpr+  
685 C3H3+ Propargyl cation c3h3+  
686 C3H5 Allyl radical allyl  
687 C3H5+ Allyl cation allyl+  
688 CH3CHCH 1-propenyl radical ch3chch  
689 Zn(CH3)2 dimethyl zinc dmz  
690 C3H7+ cyclopropane, protonated c3h7+  
691 CH3CHCH3 Isopropyl radical isopropyl  
692 CH3CHCH3+ Isopropyl cation prop2yl+  
693 Si3H8 trisilane si3h8  
694 LiCN lithium cyanide licn  
695 NaCN Sodium Cyanide nacn  
696 KCN Potassium cyanide kcn  
697 CuCN Copper cyanide cucn  
698 ZnCN Zinc monocyanide zncn  
699 ZnNC Zinc isocyanide znnc  
700 AlCN Aluminum monocyanide alcn  
701 AlNC Aluminum isocyanide alnc  
702 CN2 3H-Diazirin-3-ylidene cn2  
703 CNN Diazocarbene cnn  
704 NCN Cyanoimidogen ncn  
705 N3 azide radical n3  
706 N3- azide anion n3-  
707 N3+ azide cation n3+  
708 HCCN cyanomethylene hccn  
709 HCNN diazomethyl radical hcnn  
710 HN3+ Hydrazoic acid cation hn3+  
711 HNCNH diiminomethane hncnh  
712 CH2N2 diazirine ch2n2  
713 NH2CN cyanamide cyanamide  
714 HNNNH+ 1,2-Triazadienium n2h3+  
715 NH2NN+ hydrazoic acid, protonated nh2nn+  
716 CH3CN- acetonitrile anion ch3cn-  
717 CH3CN+ Acetonitrile cation ch3cn+  
718 CHNCH2 2H-Azirine c157164  
719 CHNHCH 1H-Azirine chnhch  
720 H2CCNH Ethenimine ch2cnh  
721 H2CNCH methyleneaminomethylene ch2nch  
722 HCCNH2 Ethynamine hccnh2  
723 HCNCH2+ 2H-Azirine cation hcnch2+  
724 HNCNH2+ diiminomethane, protonated hncnh2+  
725 NCNH3+ Cyanamide, protonated ncnh3+  
726 NH2CNH+ cyanamide, cn protonated nh2cnh+  
727 NH3CN+ cyanamide, amine protonated nh3cn+  
728 CH2CHNH vinylazine ch2chnh  
729 CH3CHN methylmethaniminyl radical ch3chn  
730 CH2CHNH2 aminoethene aminoethene  
731 CH2NCH3 N-methylmethanimine nmm  
732 CH3CHNH ethanimine ethanimine  
733 NH2BHNH2 diaminoborane nh2bhnh2  
734 C2H5NH+ Protonated Aziridine c2h5nh+  
735 C2H6N+ aziridine, protonated c2h6n+  
736 NH2CH2NH2 diaminomethane nh2ch2nh2  
737 CH3PHCH3 dimethylphosphine ch3phch3  
738 NH2CH2NH3+ diaminoethane, protonated pdam  
739 (CH3)2NH2+ dimethylammonium cation dmam  
740 CH3CH2NH3+ ethylamine, protonated pea  
741 Li2O dilithium oxide li2o  
742 Li2O+ dilithium oxide cation li2o+  
743 Li2S dilithium sulfide li2s  
744 Na2O disodium monoxide na2o  
745 Na2S Sodium sulfide na2s  
746 LiO2 Lithium dioxide lio2  
747 NaO2 Sodium superoxide nao2  
748 CCO Dicarbon monoxide cco  
749 CNO- fulminate cno-  
750 NCO isocyanato radical nco  
751 NCO- cyanate nco-  
752 SCN thiocyanato radical scn  
753 SCN- thiocyanide anion scn-  
754 BO2- Boron dioxide anion bo2-  
755 BO2+ Boron dioxide cation bo2+  
756 N2O- Nitrous oxide anion n2o-  
757 N2O+ Nitrous oxide cation n2o+  
758 NNS Nitrogen sulfide nns  
759 PPO Phosphorus oxide phosphide ppo  
760 CO2- Carbon dioxide anion co2-  
761 CO2+ Carbon dioxide cation co2+  
762 OCS+ Carbonyl sulfide cation cos+  
763 CS2- Carbon disulfide anion cs2-  
764 CS2+ Carbon disulfide cation cs2+  
765 TiO2 Titanium dioxide tio2  
766 SiS2 Silicon disulfide sis2  
767 GeO2 Germanium dioxide geo2  
768 OCSe Carbonyl selenide ocse  
769 SCSe Carbon sulfide selenide scse  
770 GeS2 Germanium disulfide ges2  
771 CSe2 Carbon diselenide cse2  
772 SCTe Carbon sulfide Telluride scte  
773 NO2- Nitrogen dioxide anion no2-  
774 NO2+ Nitrogen dioxide cation no2+  
775 NSO sulfinyl amidogen NSO  
776 PO2- Phosphorus dioxide anion po2-  
777 PO2+ Phosphorus dioxide cation po2+  
778 SNO Nitrogen oxide sulfide sno  
779 AsO2 Aresenic dioxide aso2  
780 O3- Ozone anion o3-  
781 O3+ Ozone cation o3+  
782 SO2- Sulfur dioxide anion so2-  
783 SO2+ Sulfur dioxide cation so2+  
784 S3- Sulfur trimer anion s3-  
785 S3+ Sulfur trimer cation s3+  
786 SeO2 Selenium dioxide seo2  
787 SeO2+ Selenium dioxide cation seo2+  
788 TeO2 Tellurium Dioxide teo2  
789 CS2H+ Carbon disulfide, protonated cs2h+  
790 HNCS Isothiocyanic acid hncs  
791 HSCN thiocyanic acid hscn  
792 HCO2- formate anion hco2-  
793 HNNO nitrosoazane hnno  
794 HNNO+ Nitrous oxide, N-protonated hnno+  
795 NNOH+ Nitrous Oxide, O-protonated nnoh+  
796 HCOO formate neutral radical hcoo  
797 HOCO Hydrocarboxyl radical hoco  
798 HOCO+ Hydrocarboxyl cation hoco+  
799 HNO2+ nitrous acid cation hno2+  
800 O3H+ protonated ozone o3h+  
801 SO2H+ protonated sulfur dioxide so2h+  
802 C2H2O Oxirene oxirene  
803 CH2CO+ Ketene cation ch2co+  
804 CH2CS Thioketene ch2cs  
805 Be(OH)2 Beryllium hydroxide beo2h2  
806 Mg(OH)2 Magnesium dihydroxide h2mgo2  
807 NH2NO Nitrosamide nh2no  
808 H2COO Dioxymethyl radical h2coo  
809 H2COO+ dioxymethyl cation h2coo+  
810 H2O3 Hydrogen trioxide h2o3  
811 HSSSH trisulfane hsssh  
812 NaOCH3 Sodium methoxide naoch3  
813 CH2BOH hydroxy(methylene)borane ch2boh  
814 BH3CO Borane carbonyl bh3co  
815 CH3BO Borane, methyloxo- ch3bo  
816 CH2CHO Vinyloxy radical ch2cho  
817 CH2COH+ ketene, protonated ch2coh+  
818 CH3CO Acetyl radical ch3co  
819 CH3CO- Acetyl anion ch3co-  
820 CH3CO+ acetyl cation ch3co+  
821 CH2NOH formaldoxime ch2noh  
822 CH3NO nitrosomethane ch3no  
823 CNOH3 1,2-oxaziridine cnoh3  
824 HOCHNH hydroxymethylimine hochnh  
825 CHSNH2 thioformamide chsnh2  
826 NHCHSH Methanimidothioic acid nhchsh  
827 CH2OOH CH2OOH radical ch2ooh  
828 CH3OO- methylperoxy anion ch3oo-  
829 CH3OO+ methylperoxy cation ch3oo+  
830 C2H4O+ ethylene oxide cation c2h4o+  
831 CH3CHO+ acetaldehyde cation ch3cho+  
832 H2COCH2+ Methyl, (methyleneoxoniumyl)- h2coch2+  
833 CH2CHSH Ethenethiol ch2chsh  
834 H2CONH2+ protonated formamide h2conh2+  
835 NH2CHOH+ Formamide, O-protonated nh2choh+  
836 NH3CHO+ Formamide, N-Protonated nh3cho+  
837 CH2(OH)2 methanediol ch2o2h2  
838 CH3SSH Hydrogen methyl disulfide ch3ssh  
839 HSCH2SH Methanedithiol ch4s2  
840 C2H4OH+ ethylene oxide, protonated c2h4oh+  
841 CH2CH2OH 2-hydroxy ethyl radical ch2ch2oh  
842 CH3CH2O Ethoxy radical ethoxy  
843 CH3CHOH 1-hydroxy-ethyl radical ch3choh  
844 CH3CHOH+ acetaldehyde, protonated ch3choh+  
845 CH3OCH2 methoxymethyl radical ch3och2  
846 NH2CH2OH aminomethanol nh2ch2oh  
847 CH3SCH3+ dimethyl sulfide cation mesme+  
848 CH3SeCH3 dimethylselenide dmse  
849 CuF2 Copper difluoride cuf2  
850 ZnF2 Zinc difluoride znf2  
851 CNF iso cyanogen fluoride cnf  
852 BrCN Cyanogen bromide brcn  
853 ICN Cyanogen iodide icn  
854 FBO Boron monofluoride monoxide fbo  
855 BeF2 Beryllium fluoride bef2  
856 MgF2 Magnesium fluoride mgf2  
857 BeCl2 Beryllium chloride becl2  
858 CaCl2 Calcium Chloride cacl2  
859 ZnCl2 Zinc dichloride zncl2  
860 BeBr2 Beryllium bromide bebr2  
861 CaBr2 Calcium dibromide cabr2  
862 CaF2 Calcium difluoride caf2  
863 FCO Carbonyl fluoride fco  
864 FCO+ Carbonyl fluoride cation fco+  
865 ClCO carbonyl monochloride clco  
866 BF2 Boron difluoride radical bf2  
867 FNS Thionitrosyl fluoride fns  
868 FSN Thiazyl fluoride fsn  
869 OPCl Phosphorus oxychloride opcl  
870 BrNO Nitrosyl bromide brno  
871 INO Nitrosyl iodide ino  
872 CF2- Difluoromethylene anion cf2-  
873 CF2+ Difluoromethylene cation cf2+  
874 CFCl chlorofluoromethylene cfcl  
875 SiF2 Silicon difluoride sif2  
876 SiF2+ Silicon difluoride cation sif2+  
877 CCl2- dichloromethylene anion ccl2-  
878 CCl2+ dichloromethylene cation ccl2+  
879 GeF2 Germanium difluoride gef2  
880 GeCl2 Germanium dichloride gecl2  
881 CBr2 dibromomethylene cbr2  
882 FOO+ Fluorine dioxide cation foo+  
883 ClOO+ chloroperoxy cation cloo+  
884 OClO- Chlorine dioxide anion oclo-  
885 OClO+ Chlorine dioxide cation oclo+  
886 ClSO Sulfur chloride oxide clso  
887 BrOO Bromine dioxide broo  
888 OBrO Bromine dioxide radical obro  
889 NF2+ Difluoroamino cation nf2+  
890 PF2 Phosphorus difluoride pf2  
891 PF2+ Phosphorus difluoride cation pf2+  
892 FClO chlorosyl fluoride fclo  
893 ClOF Chlorine hypofluorite clof  
894 SF2- sulfur difluoride anion sf2-  
895 SF2+ sulfur difluoride cation sf2+  
896 SeF2 Selenium difluoride sef2  
897 BrOCl Bromine hypochlorite brocl  
898 SeCl2 Selenium Dichloride secl2  
899 SBr2 Sulfur dibromide sbr2  
900 SeBr2 Selenium dibromide sebr2  
901 BrOBr Bromine oxide brobr  
902 F3- trifluoride anion f3-  
903 Cl3- trichloride anion cl3-  
904 Br3- tribromide anion br3-  
905 I3- triiodide i3-  
906 SFCl Sulfur chloride fluoride sfcl  
907 HCCF Fluoroacetylene hccf  
908 HCCF+ fluoroacetylene cation hccf+  
909 HCCCl Chloroacetylene hcccl  
910 HCCBr bromoacetylene hccbr  
911 HFCO+ formyl fluoride cation hfco+  
912 COHCl Formyl chloride cohcl  
913 COHBr Formyl bromide cohbr  
914 CHCl2 dichloromethyl radical chcl2  
915 CHF2 difluoromethyl radical chf2  
916 CHF2+ difluoromethyl cation chf2+  
917 CHFCl Chlorofluoromethyl radical chfcl  
918 CHFCl+ Chlorofluoromethyl cation chfcl+  
919 CHCl2+ dichloromethyl cation chcl2+  
920 CHBr2 dibromomethyl radical chbr2  
921 HOClO Chlorous acid hoclo  
922 NHF2 difluoramine nhf2  
923 NHCl2 dichloroamine nhcl2  
924 SiH2F2 difluorosilane sih2f2  
925 CH2BrF Methane, bromofluoro- ch2fbr  
926 CH2BrCl Methane, bromochloro- ch2clbr  
927 CH2FI fluoroiodomethane ch2fi  
928 CH2Br2 dibromomethane ch2br2  
929 CH2ClI chloroiodomethane ch2cli  
930 CH2BrI bromoiodomethane ch2bri  
931 CH2I2 Diiodomethane ch2i2  
932 CH3MgBr Methyl Magnesium Bromide ch3mgbr  
933 CH2CHF+ fluoroethene cation ch2chf+  
934 C2H3Br vinyl bromide c2h3br  
935 C2H3I Vinyl iodide c2h3i  
936 CH2FOH fluoromethanol ch2foh  
937 CH3OCl methyl hypochlorite ch3ocl  
938 CH2CH2Cl 2-chloroethyl radical ch2ch2cl  
939 CHClCH3 1-chloroethyl radical chclch3  
940 CH3SiFH2 fluoromethylsilane ch3sifh2  
941 C2H5Br Ethyl bromide etbr  
942 C2H5I Ethyl iodide c2h5i  
943 KrF2 Krypton difluoride krf2  
944 XeF2 Xenon difluoride xef2  
945 B4H10 Tetraborane(10) b4h10  
946 C4+ Carbon tetramer cation c4+  
947 C4H2+ diacetlyene cation c4h2+  
948 C4H4 cyclobutadiene cbd  
949 C4H4 Tetrahedrane c4h4  
950 CHCCH2CH3 1-Butyne c107006  
951 CH3CHCHCH2 methylallyl radical c4h7  
952 C4H8 methylcyclopropane mcp  
953 CH2CHCH2CH3 1-Butene bute1  
954 B(CH3)3 trimethylborane bme3  
955 SiH(CH3)3 trimethylsilane trimsi  
956 Li3N trilithium nitride li3n  
957 C2N2+ Cyanogen cation c2n2+  
958 As4 Arsenic tetramer as4  
959 HCCCN+ Cyanoacetylene cation hcccn+  
960 H2CNCN cyanamide, methylene ch2ncn  
961 HNCCNH Ethenediimine hnccnh  
962 C3H3N+ acrylonitrile cation ch2chcn+  
963 CH3N3 methyl azide ch3n3  
964 NH2CCNH2 Diaminoacetylene daa  
965 NH2CH2CN Aminoacetonitrile aan  
966 CH3NHN2+ methyl azide, protonated ch3nhn2+  
967 C2H5CN ethyl cyanide c2h5cn  
968 CH5N3 Guanidine guanidine  
969 C4H6 Bicyclo[1.1.0]butane c157335  
970 CH3NNCH3 (Z)-1,2-Dimethyldiazene dmdiazz  
971 H2NCHCHNH2 diaminoethylene dae  
972 CH6N3+ guanidinium ch6n3+  
973 CH7N3 triaminomethane tam  
974 C3H7N Azetidine azet  
975 CH3NHNHCH3 dimethyl hydrazine dmh  
976 NH2CH2CH2CH3 1-Propanamine pram1  
977 P(CH3)3 trimethylphosphine tmp  
978 N(SiH3)3 trisilylamine tsa  
979 As(CH3)3 trimethyl arsine tmas  
980 (CH3)3NH+ protonated trimethyl amine ptma  
981 C3H7NH3+ n-propylamine, protonated c3h7nh2  
982 Li2O2 dilithium dioxide li2o2  
983 Na2O2 disodium dioxide na2o2  
984 K2O2 dipotassium dioxide k2o2  
985 C3O Tricarbon monoxide c3o  
986 S2N2 Disulfur dinitride s2n2  
987 CO3 Carbon trioxide co3  
988 CO3-- carbonate co3--  
989 CS3-- Carbonotrithioate cs3--  
990 NO3- nitrate anion no3-  
991 NO3+ nitrogen trioxide cation no3+  
992 SO3- Sulfur trioxide anion so3-  
993 SO3-- Sulfate dianion so3--  
994 SO3+ Sulfur trioxide cation so3+  
995 SeO3 selenium trioxide seo3  
996 S4 Sulfur tetramer s4  
997 TeO3 Tellurium trioxide teo3  
998 HCO3- bicarbonate anion hco3-  
999 HSO3 Hydroxysulfonyl radical hso3  
1000 NH2NO2 nitramide nh2no2  
1001 C2H2CO cyclopropenone c2h2co  
1002 C3H2O Propadienal c3h2o  
1003 HCCCHO 2-propynal hcccho  
1004 C2H2O2+ Ethanedial cation c2h2o2+  
1005 H2CO3 Carbonic acid h2co3  
1006 H2CS3 thiocarbonic acid h2cs3  
1007 H2NO3+ Nitric Acid, Protonated h2no3+  
1008 H2SO3 Sulfurous acid h2so3  
1009 C2H3NO Nitrosoethylene c2h3no  
1010 CH3NCO methylisocyante ch3nco  
1011 HOCH2CN cyanomethanol hoch2cn  
1012 CH3COO- acetate anion ch3coo-  
1013 CH3NO2 Methane, nitro- ch3no2  
1014 NH2COOH Carbamic acid nh2cooh  
1015 H3BO3 Boric acid h3bo3  
1016 H3AlO3 Aluminum hydroxide h3alo3  
1017 H3CO3+ carbonic acid, protonated h3co3+  
1018 NH2CONH2+ Urea cation urea+  
1019 C2H4O2 1,3-dioxetane c2h4o2  
1020 NH2COOH2+ Carbamic acid, O-protonated nh2cooh2+  
1021 NH3COOH+ protonated Carbamic acid nh3cooh+  
1022 H2OHCOOH Water formic acid dimer 2 h2ohcooh_11  
1023 HOCH2OOH hydroxy methyl peroxide hoch2ooh  
1024 CH3COCH2 Acetonyl radical ch3coch2  
1025 CH2C(OH)NH2 1-amino vinyl alchohol ava  
1026 CH3C(OH)=NH Ethaninidic acid eia  
1027 HCONHCH3 N-methylformamide nmfa  
1028 CH3CSNH2 Ethanethioamide ch3csnh2  
1029 CH5N2O+ urea, N-protonated ch4n2o+  
1030 H2NCOHNH2+ urea, protonated ureah+  
1031 C2H5OO ethylperoxy radical c2h5oo  
1032 CH3NNCH3 (E)-1,2-Dimethyldiazene dmdiaze  
1033 C3H5OH Cyclopropanol cproh  
1034 C3H6O 2-Propen-1-ol c107186  
1035 C3H6O Acetone enol enol  
1036 C3H6O Oxetane oxetane  
1037 CH3COCH3- acetone anion ch3coch3-  
1038 CH3CSCH3 Thioacetone ch3csch3  
1039 C2H6O2 1,2-Ethanediol ethdiol  
1040 CH3OOCH3 dimethylperoxide dmp  
1041 CH3SOCH3 Dimethyl sulfoxide dmso  
1042 CH3COHCH3+ acetone, protonated acetoneh+  
1043 HOCH2CH2NH2 monoethanolamine mea  
1044 C3H7OH 1-Propanol proh  
1045 CH3OC2H5 Ethane, methoxy- etome  
1046 Li2F2 Lithium fluoride dimer li2f2  
1047 Na2F2 Sodium Fluoride Dimer na2f2  
1048 C2Cl2+ dichloroacetylene cation c2cl2+  
1049 FNO2 Nitryl fluoride fno2  
1050 FONO Nitrosyl hypofluorite fono  
1051 ClONO chlorine nitrite clono  
1052 BrONO Bromine nitrite brono  
1053 CF2O+ Carbonic difluoride cation f2co+  
1054 COFCl Carbonic chloride fluoride cofcl  
1055 Cl2CS Thiophosgene cl2cs  
1056 COBr2 Carbonic dibromide cobr2  
1057 BF3- Borane, trifluoro- anion bf3-  
1058 BF3+ boron trifluoride cation bf3+  
1059 BClF2 Chlorodifluoroborane bclf2  
1060 ScF3 Scandium trifluoride ScF3  
1061 BCl3+ Boron Trichloride cation bcl3+  
1062 GaF3 Gallium trifluoride gaf3  
1063 GaCl3 Gallium trichloride gacl3  
1064 BBr3 Boron tribromide bbr3  
1065 AlBr3 Aluminum Bromide albr3  
1066 ClO3 Chlorine trioxide clo3  
1067 ClO3- chlorate anion clo3-  
1068 BrO3- Bromate anion bro3-  
1069 CF3- Trifluoromethyl anion cf3-  
1070 CF3+ Trifluoromethyl cation cf3+  
1071 CF2Cl difluorochloromethyl radical cf2cl  
1072 SiF3 Silicon trifluoride radical sif3  
1073 SiF3+ Silicon trifluoride cation sif3+  
1074 CFCl2 dichlorofluoromethyl radical cfcl2  
1075 CCl3 Trichloromethyl radical ccl3  
1076 CCl3- Trichloromethyl anion ccl3-  
1077 CCl3+ Trichloromethyl cation ccl3+  
1078 SiCl3 trichlorosilyl radical sicl3  
1079 SiCl3+ trichlorosilyl cation sicl3+  
1080 CBr3 tribromomethyl radical cbr3  
1081 FOOF Perfluoroperoxide foof  
1082 ClO2F Chloryl fluoride clo2f  
1083 F2SO Thionyl Fluoride f2so  
1084 ClOOCl Dichlorine dioxide cloocl  
1085 FSSF Difluorodisulfane fssf  
1086 S2F2 Thio-thionyl fluoride s2f2  
1087 SSCl2 Thiothionyl chloride sscl2  
1088 SeOCl2 selenium oxychloride seocl2  
1089 NF3- Nitrogen trifluoride anion nf3-  
1090 NF3+ Nitrogen trifluoride cation nf3+  
1091 NCl3 nitrogen trichloride ncl3  
1092 AsF3 Arsenic trifluoride asf3  
1093 SbF3 Antimony Trifluoride sbf3  
1094 AsCl3 Arsenous trichloride ascl3  
1095 SbCl3 Antimony Trichloride sbcl3  
1096 NBr3 Nitrogen Tribromide nbr3  
1097 PBr3 Phosphorus tribromide pbr3  
1098 AsBr3 Arsenic tribromide asbr3  
1099 NI3 Nitrogen triiodide ni3  
1100 PI3 Phosphorus triiodide pi3  
1101 SF3 Sulfur trifluoride sf3  
1102 ClF3 Chlorine trifluoride clf3  
1103 BrF3 Bromine trifluoride brf3  
1104 IF3 iodone trifluoride if3  
1105 HClO3 Chloric Acid hclo3  
1106 SiHF3 trifluorosilane sihf3  
1107 CDCl3 trichloromethane-d cdcl3  
1108 CHBrF2 Methane, bromodifluoro- chbrf2  
1109 CHFClBr fluorochlorobromomethane chfclbr  
1110 CHBrCl2 Methane, bromodichloro- chbrcl2  
1111 CHF2I difluoroiodomethane chf2i  
1112 CHBr2F dibromofluoromethane chbr2f  
1113 CHFClI fluorochloroiodomethane chfcli  
1114 CHCl2I dichloroiodomethane chcl2i  
1115 CHClBr2 Methane, dibromochloro- chclbr2  
1116 CHBr3 bromoform chbr3  
1117 CHI3 Iodoform chi3  
1118 NF3H+ protonated nitrogen trifluoride nf3h+  
1119 AsF3H+ Arsenic trifluoride, protonated asf3h+  
1120 C2H2ClF 1-chloro-1-fluoroethylene c2h2clf  
1121 CHFCHCl (E)-1-chloro-2-fluoroethene chfchcle  
1122 CHFCHClz (Z)-1-Chloro-2-fluoroethene chfchclz  
1123 C2H2Br2 1,1-dibromoethene c2h2br2  
1124 CHBrCHBr Ethene, 1,2-dibromo-, (E)- chbrchbre  
1125 CHBrCHBr Ethene, 1,2-dibromo-, (Z)- chbrchbrz  
1126 CH2FCHO Fluoroacetaldehyde ch2fcho  
1127 CH2ClCHO chloroacetaldehyde ch2clcho  
1128 C2H4F2 1,2-difluoroethane c2h4f2  
1129 CH2FCH2Cl Ethane, 1-chloro-2-fluoro- ch2fch2cl  
1130 CH2BrCH2Cl 1-bromo-2-chloroethane ch2brch2cl  
1131 CH2BrCH2Br Ethane, 1,2-dibromo- ch2brch2br  
1132 CH2CFCH3 2-fluoropropene 2fpro  
1133 CH2CHCH2F Allyl Fluoride allylf  
1134 CH3CHCHF trans-1-Fluoro-1-propene propene1ft  
1135 CH2FCH2OH 2-fluoroethanol ch2fch2oh  
1136 CH2ClCH2OH 2-Chloroethanol ch2clch2oh  
1137 CH2ClCH2OH2+ 2-chloroethanol, protonated ch2clch2oh2+  
1138 CH2FCH2CH3 1-Fluoropropane prf1  
1139 CH3CHFCH3 2-Fluoropropane prf2  
1140 CH2ClCH2CH3 Propane, 1-chloro- prcl1  
1141 CH3CHClCH3 Propane, 2-chloro- prcl2  
1142 CH3CH2CH2Br n-propyl bromide prbr  
1143 CH3CHBrCH3 i-propyl bromide iprbr  
1144 C3H9O+ trimethyl oxonium cation c3h9o+  
1145 B5H9 pentaborane9 b5h9  
1146 C5H4 pentatetraene ptrene  
1147 C5H5 cyclopentadienyl radical c5h5  
1148 C5H5- cylopentadienyl anion c5h5-  
1149 C5H6 Propellane propellane  
1150 C5H7 1,3-pentadienyl radical pdyl  
1151 C5H7 cyclopentenyl radical cpyl  
1152 C5H8 1-pentyne a1pentyne  
1153 C5H8 Bicyclo[1.1.1]pentane bcp  
1154 C5H8 Ethenylcyclopropane c693867  
1155 CH3CCCH2CH3 2-Pentyne 2pentyne  
1156 CH2N4 1H-Tetrazole 1htz  
1157 C3H3N2 imidazolyl radical im  
1158 C3H3N2- imidizolyl anion im-  
1159 C2H3N3 1H-1,2,4-Triazole c288880  
1160 C4H4N pyrrolide radical c4h4n  
1161 C4H4N- pyrrolide anion c4h4n-  
1162 C3H4N2 2H-Imidazole imid2h  
1163 C3H4N2 4H-Imidazole imid4h  
1164 C4H5N 2H-pyrrole pyrrole2  
1165 C4H5N 3H-pyrrole pyrrole3  
1166 CH2CHCH2CN Allylcyanide ch2chch2cn  
1167 C4H6N+ pyrrole, alpha-protonated appyr  
1168 C4H6N+ pyrrole, beta-protonated bppyr  
1169 C4H6N+ pyrrole, protonated ppyr  
1170 CH3CH(CH3)CN Propanenitrile, 2-methyl- c4h7n  
1171 CH3CH2CH2CN Butanenitrile c109740  
1172 C(CH3)3NH2 2-Propanamine, 2-methyl- c75649  
1173 NH(C2H5)2 diethylamine dea  
1174 NC4H12+ tetramethyl ammonium cation nc4h12+  
1175 C3O2+ Carbon suboxide cation c3o2+  
1176 B2O3 diboron trioxide b2o3  
1177 MgCO3 Magnesium Carbonate mgco3  
1178 BeCO3 Beryllium Carbonate beco3  
1179 CaCO3 Calcium Carbonate caco3  
1180 ONONO Nitrosyl nitrite onono  
1181 PO4--- phosphate po4---  
1182 SO4-- sulfate so4--  
1183 HOONO2 peroxy nitric acid hoono2  
1184 HSO4- bisulfate anion hso4-  
1185 C2H2N2S 1,3,4-Thiadiazole c2h2n2s  
1186 C3H2O2 Propiolic acid c3h2o2  
1187 CHOCOOH oxo acetic acid oaa  
1188 CHOOCHO diformyl ether choocho  
1189 H2SeO4 Selenic acid h2seo4  
1190 C3H3NO Oxazole oxazole  
1191 C3H3NS Thiazole thiazole  
1192 CH3C(O)OO acetyl peroxy radical ch3coo2  
1193 H3PO4 Phosphoric Acid h3po4  
1194 C4H4O+ Furan cation furan+  
1195 CH3COCCH 3-butyn-2-one c1423605  
1196 C4H4Se selenophene c4h4se  
1197 C3H4O2 Methyl glyoxal megly  
1198 HOCHCCHOH allenediol aldiol  
1199 C2H4O3 1,2,3-trioxolane c2h4o3  
1200 C2H4O3 trioxolane124 triox  
1201 HOCH2COOH Hydroxyacetic acid hac  
1202 CH3SO2NH2 methanesulfonamide ch3so2nh2  
1203 CH3CH2COOH Propanoic Acid propanoic  
1204 HCOOC2H5 Ethyl formate faee  
1205 C3H7NO dimethylformamide dmf  
1206 C4H8O Furan, tetrahydro- thf  
1207 CH3COCH2CH3 2-Butanone buta2one  
1208 C3H8O2 Methane, dimethoxy- c109875  
1209 C4H10O 1-Butanol butanol1  
1210 C4H10O Methyl propyl ether meopr  
1211 C4H10O+ 1-Butanol cation butanol1+  
1212 C(CH3)3SH 2-Propanethiol, 2-methyl- tbush  
1213 C4H9SH 1-Butanethiol bush  
1214 ClONO2 Chlorine nitrate clono2  
1215 BrONO2 Bromine nitrate brono2  
1216 TiCl4 Titanium tetrachloride ticl4  
1217 ClO4- perchlorate anion clo4-  
1218 BF4- tetrafluoroboron anion bf4-  
1219 SO2F2 Sulfuryl fluoride so2f2  
1220 TiF4 Titanium tetrafluoride tif4  
1221 CF3Br Bromotrifluoromethane cf3br  
1222 GeF4 Germanium tetrafluoride gef4  
1223 CCl4+ Carbon tetrachloride cation ccl4+  
1224 CBrClF2 Methane, bromochlorodifluoro- cbrclf2  
1225 CBrCl2F bromodichlorofluoromethane cbrcl2f  
1226 CF3I trifluoroiodomethane cf3i  
1227 CBrCl3 Methane, bromotrichloro- cbrcl3  
1228 CBr2F2 Methane, dibromodifluoro- cbr2f2  
1229 GeCl4 Germanium Tetrachloride gecl4  
1230 CBr2ClF dibromochlorofluoromethane cbr2clf  
1231 CBr2Cl2 dibromodichloromethane cbr2cl2  
1232 CCl3I trichloroiodomethane ccl3i  
1233 CFBr3 fluorotribromomethane cfbr3  
1234 CFClBrI fluorochlorobromoiodomethane cfclbri  
1235 CBr3Cl tribromochloromethane cbr3cl  
1236 CF2I2 difluorodiiodomethane cf2i2  
1237 CBr4 Carbon tetrabromide cbr4  
1238 CCl2I2 dichlorodiiodomethane ccl2i2  
1239 SiBr4 Silicon tetrabromide sibr4  
1240 CBr3I tribromoiododmethane cbr3i  
1241 GeBr4 Germanium tetrabromide gebr4  
1242 CI4 tetraiodomethane ci4  
1243 SiI4 silicon tetraiodide sii4  
1244 ClOF3 Chlorine trifluoride oxide clof3  
1245 SeF4 Selenium tetrafluoride sef4  
1246 SCl4 Sulfur tetrachloride scl4  
1247 C2HF3+ Trifluoroethylene cation c2hf3+  
1248 CHBrCF2 1-Bromo-2,2-difluoroethylene chbrcf2  
1249 HClO4 perchloric acid hclo4  
1250 CF3OH trifluoromethanol cf3oh  
1251 CH2ClCCCl 1,3-dichloropropyne ch2clcccl  
1252 CHClCCHCl 1,3-dichloroallene chclcchcl  
1253 CHCl2CCH 3,3-dichloropropyne chcl2cch  
1254 CHCl2CHO dichloroacetaldehyde chcl2cho  
1255 PF3CH2 phosphorane, trifluoromethylene- pf3ch2  
1256 CHF2CH2F Ethane, 1,1,2-trifluoro ch2fchf2  
1257 CH3CF2Cl 1-Chloro-1,1-Difluoroethane ch3cf2cl  
1258 CH3CFCl2 1,1-Dichloro-1-fluoroethane ch3cfcl2  
1259 SiCl3CH3 methyltrichlorosilane sicl3ch3  
1260 CH3CBr3 1,1,1-tribromoethane ch3cbr3  
1261 NH3BCl3 Amminetrichloroboron nh3bcl3  
1262 SiH3CCl3 (trichloromethyl)silane sih3ccl3  
1263 CH2CClCHCH2 1,3-Butadiene, 2-chloro- c4h5cl  
1264 CH2FCH2CH2F 1,3-difluoropropane ch2fch2ch2f  
1265 CH3CF2CH3 2,2-difluoropropane ch3cf2ch3  
1266 CH2ClCH2CH2Cl 1,3-dichloropropane prdicl13  
1267 CHCl2CH2CH3 1,1-dichloropropane prdicl11  
1268 SiCl2(CH3)2 dichlorodimethylsilane sicl2me2  
1269 CH2ClCHCHCH3 2-Butene, 1-chloro- bute2cl1  
1270 C4H9F 1-fluorobutane butaf1  
1271 CH3CHFCH2CH3 2-fluorobutane butaf2  
1272 XeF4 Xenon tetrafluoride xef4  
1273 C2H2N2O Furazan furazan  
1274 CF3PH2 phosphine, (trifluoromethyl)- cf3ph2  
1275 NH3BF3 Amminetrifluoroboron nh3bf3  
1276 C6H2 hexatriyne c6h2  
1277 C6H4 Benzyne benzyne  
1278 C6H5 phenyl phenyl  
1279 C6H5- phenyl anion phenyl-  
1280 C6H6 Prismane prismane  
1281 C6H6 1,2,4,5-Hexatetraene ht1245  
1282 C6H6 3,4-Dimethylenecyclobutene cb34m  
1283 C6H6 Benzvalene bv  
1284 C6H6 Dewar Benzene dewar  
1285 C6H6 Hexa-1,5-diene-3-yne hdy153  
1286 C6H6 Trimethylenecycopropane tmcp  
1287 C6H6+ Benzene cation c6h6+  
1288 C6H7+ benzene, protonated c6h7+  
1289 C6H8 (E)-hexa-2,3,4-triene c59660650  
1290 C6H8 1,3-Cyclohexadiene cyhexadiene13  
1291 C6H10 1,5-Hexadiene c592427  
1292 C6H10 3-Hexyne hexyne3  
1293 C4H6(CH3)2 1,1-dimethylcyclobutane dmcb11  
1294 C6H12 (1R,2R)-1,2-dimethylcyclobutane dmcb12t  
1295 C6H12 (1r,3r)-1,3-dimethylcyclobutane dmcb13t  
1296 C6H12 (E)-2-Hexene e2hexene  
1297 C6H12 (E)-hex-3-ene e3hexene  
1298 C6H12 (Z)-hex-2-ene z2hexene  
1299 C6H12 (Z)-hex-3-ene z3hexene  
1300 C6H12 2,3-dimethylbut-1-ene c563780  
1301 C6H12 2,3-dimethyl-but-2-ene tmeet  
1302 C6H12 3-methylenepentane c760214  
1303 C6H12 cis-1,2-dimethylcyclobutane dmcb12c  
1304 C6H12 cis-1,3-dimethylcyclobutane dmcb13c  
1305 C6H12 hex-1-ene hexene1  
1306 N3P3 1,3,5,2,4,6-Triazatriphosphorine n3p3  
1307 C4H2N2 Fumaronitrile c4h2n2  
1308 C2H2N4 sym-tetrazine ttz  
1309 C3H3N3 1,3,5-Triazine triazine135  
1310 C5H5N E-2,4-pentadienenitrile bdcn  
1311 B3N3H6 borazine borazine  
1312 C6H6 Fulvene fulvene  
1313 C5H6N+ Pyridinium c5h6n  
1314 C6H10 Bicyclo[3.1.0]hexane c285585  
1315 Li2CO3 Lithium Carbonate li2co3  
1316 Na2CO3 Sodium Carbonate na2co3  
1317 C2O4-- oxalate anion c2o4  
1318 MgSO4 Magnesium Sulfate mgso4  
1319 C3H2O3 vinylene carbonate vica  
1320 C2H2O4 Oxalic Acid oxalic  
1321 C4H4O2 2(5H)-Furanone furanone  
1322 C2H4N2S2 Ethanedithioamide c79403  
1323 C2H4CO3 Ethylene carbonate etco3  
1324 C2H4O4 Formic acid dimer fadimer  
1325 C2H5NO3 Nitric acid, ethyl ester c625581  
1326 C5H6O 2H-Pyran pyran2  
1327 C5H6O 2-methylfuran furan2m  
1328 C5H6O 3-Methylfuran furan3m  
1329 C5H6O Pentadienal pdal  
1330 C4H6O2 2,3-Butanedione c431038  
1331 C4H6O2 Crotonic Acid crot  
1332 C3H6S3 1,3,5-Trithiane c3h6s3  
1333 C4H7NO Ethoxyacetonitrile etoaccn  
1334 C3H7ONO Propyl nitrite prono  
1335 C5H8O Cyclopentanone c120923  
1336 C5H8O Methyl cyclopropyl ketone c765435  
1337 NH(CH3)CONH(CH3) Urea, N,N'-dimethyl- c96311  
1338 C4H8O2 1,3-Dioxane dioxan13  
1339 C4H8O2 Ethyl acetate c141786  
1340 C5H10O 2-methylbutyraldehyde 2meba  
1341 C4H10OS Diethyl sulfoxide c70291  
1342 C5H12O 3-Pentanol pentan3ol  
1343 C5H12S 2-Butanethiol, 2-methyl- c1679090  
1344 C4F2 difluorobutadiyne c4f2  
1345 ClCOClCO Oxalyl chloride oxcl  
1346 CF3CN+ Acetonitrile, trifluoro- cation cf3cn+  
1347 C2F4+ Tetrafluoroethylene cation c2f4+  
1348 C2ClF3 Ethene, chlorotrifluoro- c2f3cl  
1349 CF2CCl2 difluorodichloroethylene cf2ccl2  
1350 CFClCClF trans-1,2-dichloro-1,2-difluoroethylene cfclcclf  
1351 CFClCFCl cis-1,2-dichloro-1,2-difluoroethylene cfclcfcl  
1352 C2FCl3 fluorotrichloroethene c2fcl3  
1353 C2Br4 tetrabromoethene c2br4  
1354 CF3OF Trifluoromethylhypofluorite cf3of  
1355 SiF5- silicon pentafluoride anion sif5-  
1356 SOF4 Sulfur tetrafluoride oxide sof4  
1357 AsF5 Arsenic pentafluoride asf5  
1358 SF5 Sulfur pentafluoride sf5  
1359 SF5+ pentafluoro sulfur cation sf5+  
1360 SbCl5 Antimony pentachloride sbcl5  
1361 BrF5 bromine pentafluoride brf5  
1362 ClF5 chlorinepentafluoride clf5  
1363 IF5 pentafluoroiodine if5  
1364 CF3CHO trifluoroacetaldehyde cf3cho  
1365 CCl3CHO trichloroacetaldehyde ccl3cho  
1366 CHFClCHClF ethane, 1,2-dichloro-1,2-difluoro- chfclchclf  
1367 CF3CH2F 1,1,1,2-tetrafluoroethane cf3ch2f  
1368 CHF2CHF2 1,1,2,2-tetrafluoroethane chf2chf2  
1369 CF3CH2Cl 2,2,2-Trifluoroethyl chloride cf3ch2cl  
1370 CHFClCHFCl 1,2-dichloro-1,2-difluoroethane RR chfclchfcl  
1371 CH2ClCCl3 1,1,1,2-tetrachloroethane ch2clccl3  
1372 CHCl2CHCl2 Ethane, 1,1,2,2-tetrachloro- chcl2chcl2  
1373 CH2BrCBr3 1,1,1,2-tetrabromo ethane c2h2br4  
1374 CHCl2CHF2 1,1-dichloro-2,2-difluoroethane c2h2cl2f2  
1375 CF3COOH trifluoroacetic acid cf3cooh  
1376 C4H3ClO Furan, 2-chloro fur2cl  
1377 C4H3ClO Furan,3-chloro fur3cl  
1378 C4H8Cl2 Butane, 2,3-dichloro-, (r*,r*)-(.+/-.)- c2211678  
1379 C4H8O2 Butanoic acid bua  
1380 C7H7 cycloheptatrienyl radical c7h7  
1381 C7H7+ cycloheptatrienyl cation c7h7+  
1382 C7H8 cycloheptatriene cht  
1383 C7H8 Norbornadiene norbor  
1384 C7H8 Quadricyclane qucy  
1385 C7H14 cycloheptane c7h14  
1386 C7H16 3-methylhexane hex3m  
1387 CH(CN)3 tricyanomethane mecn3  
1388 HN=C=C(CN)2 Dicyanoketenimine c4hn3  
1389 C6H7N 2-Methylpyridine mp  
1390 C6H13N 2-Methylpiperidine pip2m  
1391 C6H13N cyclohexanamine cham  
1392 C6H15N triethylamine tea  
1393 N2O5 Dinitrogen pentoxide n2o5  
1394 C4H2O3 Maleic Anhydride malan  
1395 C5H4O2 4-Cyclopentene-1,3-dione cpdio  
1396 C5H4O2 furfural furfural  
1397 C6H5O phenoxy radical phenoxy  
1398 C6H6O 2,5-Cyclohexadienone c5664335  
1399 C6H5SH Benzenethiol phsh  
1400 HO2CCHNH2CH2OH Serine serine  
1401 C5H8O2 Acetylacetone acac  
1402 C4H8O2S Sulfolane sulfolane  
1403 C7H10 Norbornene norbornene  
1404 CH(C2H3)3 trivinyl methane tvm  
1405 C6H12O hexanal c6h12o  
1406 C6H12O Oxepane oxepane  
1407 C3H7OC3H7 di-n-propyl ether propr  
1408 F2CCCF2 tetrafluoroallene pfa  
1409 CF3COO- trifluoro acetate anion cf3coo-  
1410 CF3COF trifluoroacetyl fluoride cf3cof  
1411 CF3COCl trifluoroacetyl chloride cf3cocl  
1412 PF6 Hexafluorophosphate neutral pf6  
1413 PF6- Hexafluorophosphate ion pf6-  
1414 SeF6 Selenium hexafluoride sef6  
1415 SF5Cl sulfur chloropentafluoride sf5cl  
1416 CF3CHF2 pentafluoroethane cf3chf2  
1417 CF3CHFCl 1,1,1,2-tetrafluorochloroethane cf3chfcl  
1418 CF3CHCl2 1,1-Dichloro-2,2,2-trifluoroethane cf3chcl2  
1419 CHCl2CClF2 Ethane, 1,2,2-trichloro-1,1-difluoro- chcl2cclf2  
1420 CCl3CHCl2 pentachloroethane ccl3chcl2  
1421 C6H5Br bromobenzene bzbr  
1422 C8H6 Calicene calicene  
1423 C8H6 benzocyclobutadiene bcbd  
1424 C8H6 Pentalene pentalene  
1425 CH3C6H4CH3 meta-xylene mxylene  
1426 CH3C6H4CH3 paraxylene pxylene  
1427 C8H14 Bicyclo[2.2.2]octane bico222  
1428 C8H16 cyclooctane cyclooct  
1429 (CH3)3CC(CH3)3 tetramethylbutane tmb  
1430 C8H18 Octane c8h18  
1431 C6H5CN phenyl cyanide phcn  
1432 C6H12N2 Triethylenediamine ted  
1433 C4O4-- squarate dianion c4o4--  
1434 S4N4 Tetrasulfur tetranitride s4n4  
1435 C6H4O2 parabenzoquinone pbq  
1436 C4H4N2O2 Uracil uracil  
1437 C5H9NO2 Proline proline  
1438 C6H12O2 Methyl pivalate c598981  
1439 C6H12O2 Hexanoic acid hexa  
1440 C4F4 tetrafluorcyclobutadiene c4f4  
1441 Al2Cl6 Aluminum, di-μ-chlorotetrachlorodi- al2cl6  
1442 CF3CF2Cl pentafluorochloroethane cf3cf2cl  
1443 CF2ClCF2Cl 1,2-Dichloro-1,1,2,2-tetrafluoroethane cf2clcf2cl  
1444 CF3CFCl2 1,1-Dichlorotetrafluoroethane cf3cfcl2  
1445 CF2ClCFCl2 Ethane, 1,1,2-trichloro-1,2,2-trifluoro- cf2clcfcl2  
1446 CF3CCl3 1,1,1-trifluoro-2,2,2-trichloroethane cf3ccl3  
1447 C2Cl6 hexachloroethane c2cl6  
1448 IF7 Iodine heptafluoride if7  
1449 C6H4F2 metadifluorobenzene mdfb  
1450 C6H4F2 orthodifluorobenzene odfb  
1451 C6H4F2 1,4-difluorobenzene pdfb  
1452 C6H4Cl2 1,2-dichlorobenzene dcb12  
1453 C6H4Cl2 1,3-dichlorobenzene dcb13  
1454 C6H4Cl2 1,4-dichlorobenzene dcb14  
1455 C6H5NO nitrosobenzene bzno  
1456 C9H8 Indene indene  
1457 C9H8 spiro[4.4]nona-1,3,6,8-tetraene snt  
1458 C9H12 n-propyl benzene prbz  
1459 C9H20 Nonane nonane  
1460 C(CN)4 tetracyanomethane c5n4  
1461 C5H4N4 purine purine  
1462 C3H3N3O3 cyanuric acid cyanuric  
1463 CH3COC6H5 acetophenone acph  
1464 C3Cl3N3 1,3,5-Triazine, 2,4,6-trichloro- c3cl3n3  
1465 C3F6 hexafluoropropene c3f6  
1466 C6H3F3 Benzene trifluoride 123 bzf3a  
1467 C8H18O 1-Octanol octanol  
1468 C10H8 Azulene azu  
1469 C10H10 bullvalene bullv  
1470 C6N4 Tetracyanoethylene tcne  
1471 C6N4- tetracyanoethylene anion tcne-  
1472 C10H22 Decane decane  
1473 C4F6 perfluorobutadiene c4f6  
1474 SF5CF3 Sulfur, pentafluoro(trifluoromethyl)- sf5cf3  
1475 C3F8 perfluoropropane c3f8  
1476 Fe(CO)5 Iron pentacarbonyl ipc  
1477 Fe(C5H5)2 ferrocene fecp2  
1478 B12H12-- Dodecahydrododecaborate(2-) b12h12--  
1479 B12H12-- Dodecahydrododecaborate(2-) b12h12--  
1480 C12H8 Acenaphthylene acenaph  
1481 C12H8 biphenylene biph  
1482 C12H10 Heptalene heptalene  
1483 C6H12O6 Inositol inositol  
1484 C6F6 hexafluorobenzene c6f6  
1485 S2F10 disulphur decafluoride s2f10  
1486 C13H10 Fluorene fluorene  
1487 C14H10 Anthracene anth  
1488 C14H10 Phenanthrene phenanthrene  
1489 C14H14 Bibenzyl bibenzyl  
1490 C12H10N2 azobenzene azobenzene  
1491 C6H5COC6H5 benzophenone benzophenone  
1492 C16H10 Pyrene pyrene  
1493 C18H12 Tetracene tetracene  
1494 C19H16 Triphenylmethane tpm  
1495 C24H12 Coronene coronene  
1496 C60 Buckminsterfullerene c60