return to home page Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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List of which calculations are completed at QCISD(TQ) /aug-cc-pVTZ

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count Species Name State Conformation
1 H Hydrogen atom 1SKh
2 H2- hydrogen diatomic anion 2Σu+D∞h
3 He Helium atom 1SKh
4 He Helium atom   
5 Li Lithium atom 2SKh
6 MgH magnesium monohydride 2ΣC∞v
7 MgH2 magnesium dihydride 1ΣgD∞h
8 B Boron atom 2PKh
9 Al- Aluminum atom anion 3PKh
10 BH Boron monohydride 1ΣC∞v
11 BH Boron monohydride 3ΠC∞v
12 ScH Scandium monohydride 1ΣC∞v
13 BH3+ boron trihydride cation 2B2C2v
14 BH3+ boron trihydride cation  C2v
15 AlH3 aluminum trihydride 1A1'D3h
16 AlH3- aluminum trihydride anion  C3v
17 ScH3 Scandium trihydride 1A1'D3h
18 ScH3 Scandium trihydride 1A1C3v
19 BH4 borohydride 2B2C2v
20 BH4- borohydride anion 1A1Td
21 C Carbon atom 3P0Kh
22 C Carbon atom 3P1Kh
23 C- Carbon atom anion 2DKh
24 Si Silicon atom 1SKh
25 Si- Silicon atom anion 4SKh
26 SiH Silylidyne 2ΠC∞v
27 SiH+ silicon monohydride cation 1ΣC∞v
28 GeH germylidene 2ΠC∞v
29 GeH+ Germaniun monohyrdide cation 1ΣC∞v
30 CH2 Methylene 3B1C2v
31 CH2 Methylene 3ΣGD∞h
32 CH2 Methylene 1A1C2v
33 CH2- methylene anion 2B1C2v
34 CH2+ methylene cation 2A1C2v
35 CH2+ methylene cation 2ΠD∞h
36 GeH2 germylene 1A1C2v
37 CH3 Methyl radical 2A1D3h
38 CH3- methyl anion 1A1C3v
39 CH3+ methyl cation 1A1'D3h
40 SiH3 Silyl radical 2A1C3v
41 SiH3+ Silyl cation 1A1'D3h
42 CH4 Methane 1A1Td
43 CH4- Methane anion 2A1Td
44 CH4- Methane anion 2A1C3v
45 SiH2D2 silane-d2   
46 SiH4 Silane 1A1Td
47 GeH4 Germane 1A1Td
48 SiH5+ Silane, protonated   
49 N Nitrogen atom 4SKh
50 N Nitrogen atom 2DKh
51 P Phosphorus atom 4SKh
52 V Vanadium atom 4FKh
53 V+ Vanadium atom cation 5DKh
54 As Arsenic atomic 4SKh
55 As- Arsenic anion 3PKh
56 As+ Arsenic cation 3PKh
57 PH phosphorus monohydride 3Σ-C∞v
58 NH2 Amino radical 2B1C2v
59 NH2+ Amino cation 3B1C2v
60 NH2+ Amino cation 1A1C2v
61 NH3 Ammonia 1A1C3v
62 NH3- Ammonia anion 2A1C3v
63 NH3+ ammonia cation 2A2"D3h
64 PH3 Phosphine 1A1C3v
65 PH3+ Phosphine cation 2A1C3v
66 NH4+ ammonium cation 1A1Td
67 PH4 Phosphoranyl radical   
68 PH4+ phosphonium cation   
69 O Oxygen atom 3SKh
70 O+ Oxygen atom cation 4SKh
71 S Sulfur atom 3PKh
72 S- Sulfur atom anion 2PKh
73 S+ Sulfur atom cation 4SKh
74 OH Hydroxyl radical 2ΠC∞v
75 OH- hydroxide anion 1ΣC∞v
76 OH+ hydoxyl cation 3ΣC∞v
77 HS Mercapto radical 2ΠC∞v
78 HS- mercapto anion 1ΣC∞v
79 HS+ sulfur monohydride cation 3ΣC∞v
80 CrH+ Chromium hydride cation 5ΣC∞v
81 HSe+ selenium monohydride cation 3ΣC∞v
82 H2O Water 1A1C2v
83 H2O- water anion 2A1C2v
84 H2O- water anion 2A'Cs
85 H2O+ water cation 2B1C2v
86 HDO Water-d1 1A1C2v
87 H2S Hydrogen sulfide 1A1C2v
88 H2S+ Hydrogen sulfide cation 2B1C2v
89 H2Se Hydrogen selenide 1A1C2v
90 H3O+ hydronium cation 1A1C3v
91 H3S+ Sulfonium cation 1A1C3v
92 H3Se+ Hydrogen Selenide, protonated 1A1C3v
93 F Fluorine atom 2PKh
94 F- Fluorine atom anion 1SKh
95 F+ Fluorine atom cation 3SKh
96 F+ Fluorine atom cation 1DKh
97 Cl Chlorine atom 2PKh
98 Cl- Chlorine atom anion 1SKh
99 Cl+ Chlorine atom cation 3PKh
100 Cl+ Chlorine atom cation 1DKh
101 HF Hydrogen fluoride 1ΣC∞v
102 HCl Hydrogen chloride 1ΣC∞v
103 HCl+ hydrogen chloride cation 2ΠC∞v
104 HBr hydrogen bromide 1ΣC∞v
105 H2Cl+ dihydrogen monochloride cation 1A1C2v
106 H2Br+ protonated hydrogen bromide 2A1C2v
107 Ne Neon atom 1SKh
108 Ne Neon atom   
109 Ne+ Neon atom cation 2PKh
110 Ar Argon atom 1SKh
111 Kr Krypton atom 1SKh
112 Kr+ Krypton cation 2PKh
113 ArH+ Argon hydride cation 1ΣC∞v
114 KrH+ Protonated Krypton 1ΣC∞v
115 Na2 Sodium diatomic 1ΣgD∞h
116 Na2- sodium diatomic anion 2ΣuD∞h
117 Na2+ sodium diatomic cation 2ΣgD∞h
118 Be2 Beryllium diatomic 1ΣgD∞h
119 BeMg Beryllium Magnesium 1ΣC∞v
120 NaAl Sodium aluminum 1ΣC∞v
121 BeB Beryllium monoboride 2ΠC∞v
122 B2 Boron diatomic 1ΣgD∞h
123 B2+ Boron diatomic cation 2ΠD∞h
124 BAl Boron Aluminum 3ΣC∞v
125 BGa Boron Gallium 3ΣC∞v
126 AlGa Aluminum Gallium 3ΣC∞v
127 AlGa Aluminum Gallium 1ΣC∞v
128 Ga2 Gallium diatomic 3Piu 
129 HBBH Diborane(2) 3ΣGD∞h
130 B2H4 Diborane(4) D2d 1A1D2d
131 HBHHBH Diborane(4) C2V 1A1C2v
132 B2H6 Diborane 1AgD2h
133 B2H6+ Diborane cation   
134 Ga2H6 digallane 1AGD2h
135 BeC Beryllium Carbide 3Σ-C∞v
136 BeC Beryllium Carbide   
137 AlC Aluminum carbide 4ΣC∞v
138 BSi Boron silicide 4ΣC∞v
139 BSi Boron silicide 2ΣC∞v
140 C2 Carbon diatomic 1Σg+D∞h
141 C2 Carbon diatomic 3ΠuD∞h
142 C2 Carbon diatomic 3Σg- 
143 C2+ carbon diatomic cation 4ΣgD∞h
144 SiGe Silicon Germanium   
145 C2H Ethynyl radical 2ΣC∞v
146 C2H- Ethynyl anion 1ΣC∞v
147 C2H2 Acetylene 1ΣgD∞h
148 C2H2+ acetylene cation 2ΠuD∞h
149 H2CC- vinylidene anion   
150 CH3Li methyl lithium 1A1C3v
151 CH2BH methyleneborane 1A1C2v
152 C2H3 vinyl 2A'Cs
153 C2H3- vinyl anion 1A'Cs
154 C2H4 Ethylene 1AgD2h
155 C2H4- Ethylene anion 2AgC2h
156 C2H4+ Ethylene cation 2B3D2
157 CH3BH2 methylborane 1A'Cs
158 C2H5 Ethyl radical 2A'Cs
159 C2H6 Ethane 1A1gD3d
160 Si2H6 disilane 1EuD3d
161 LiP Lithium monophosphide   
162 LiP Lithium monophosphide   
163 BeN+ Beryllium mononitride cation 3ΣC∞v
164 BeN+ Beryllium mononitride cation 1ΣC∞v
165 MgN Magnesium Nitride   
166 BP Boron monophosphide 3ΠC∞v
167 BP Boron monophosphide 1ΣC∞v
168 AlP Aluminum monophosphide 3ΣC∞v
169 AlP Aluminum monophosphide 3ΠC∞v
170 AlP Aluminum monophosphide 1ΣC∞v
171 GaN Gallium mononitride 1ΣC∞v
172 GaP Gallium monophosphide 3ΣC∞v
173 GaP Gallium monophosphide 1ΣC∞v
174 GaAs Gallium arsenide 3Π 
175 GaAs Gallium arsenide 1Σ 
176 BN boron nitride 3ΠC∞v
177 BN boron nitride 1ΣC∞v
178 CN Cyano radical 2ΣC∞v
179 CN- cyanide anion 1ΣC∞v
180 SiP Silicon monophosphide 2ΠC∞v
181 N2 Nitrogen diatomic 1ΣgD∞h
182 N2- nitrogen diatomic anion 2ΠgD∞h
183 HCN Hydrogen cyanide 1ΣC∞v
184 HCN+ hydrogen cyanide cation 2ΠC∞v
185 HNC+ hydrogen isocyanide cation   
186 NNH+ Dinitrogen monohydride cation 1ΣC∞v
187 N2H2 (E)-diazene 1AgC2h
188 N2H2 (Z)-Diazene 1A1C2v
189 N2H2+ trans-diazene cation 2AGC2h
190 CH2NH+ Methanimine cation   
191 CH2NH2+ methyleneamine cation 1A1C2v
192 CH3NH2 methyl amine 1A'Cs
193 CH3NH2+ methyl amine cation 2A'Cs
194 NH3NH3 Ammonia Dimer 1AgC2h
195 N2H7+ ammonia ammonium dimer   
196 LiO lithium oxide 2ΣC∞v
197 LiS Lithium monosulfide 2ΠC∞v
198 LiS+ Lithium sulfide cation 3ΣC∞v
199 NaO sodium monoxide 2ΣC∞v
200 NaS Sodium sulfide 2ΠC∞v
201 BO boron monoxide 2ΣC∞v
202 ScO Scandium monoxide 2ΣC∞v
203 CO Carbon monoxide 1ΣC∞v
204 CO- carbon monoxide anion 2ΠC∞v
205 CO+ carbon monoxide cation 2ΣC∞v
206 TiO Titanium monoxide 3ΔC∞v
207 GeO+ Germanium monoxide cation 2ΣC∞v
208 GeS Germanium monosulfide 1ΣC∞v
209 SiSe Silicon Monoselenide   
210 SiSe+ Silicon Monoselenide cation   
211 NO Nitric oxide 2ΠC∞v
212 NO- nitric oxide anion 3ΣC∞v
213 NO+ nitric oxide cation 1ΣC∞v
214 NS Mononitrogen monosulfide 2ΠC∞v
215 PO Phosphorus monoxide 2ΠC∞v
216 PS phosphorus sulfide 2ΣC∞v
217 VO Vanadium monoxide 4Σ- 
218 NSe Nitrogen monoselenide 2ΠC∞v
219 AsS Arsenic monosulfide 2ΠC∞v
220 PSe Phosphorus monoselenide 2ΠC∞v
221 AsSe Arsenic monoselenide 2ΠC∞v
222 O2 Oxygen diatomic 3ΣgD∞h
223 O2- oxygen diatomic anion 2ΠD∞h
224 SO+ sulfur monoxide cation 2ΠC∞v
225 S2 Sulfur diatomic 3ΣgD∞h
226 LiOH lithium hydroxide 1ΣC∞v
227 BeOH beryllium monohydroxide 2ΣC∞v
228 HBO Boron hydride oxide 1ΣC∞v
229 COH Hydroxymethylidyne   
230 COH+ Carbon Monoxide, protonated 1ΣC∞v
231 HCO- formyl anion 1A'Cs
232 HNO+ Nitrosyl hydride cation 2A'Cs
233 NOH Hydroxyimidogen 3A"Cs
234 NOH+ O-protonated nitric oxide 2A'Cs
235 HO2 Hydroperoxy radical 2A"Cs
236 HO2+ Hydroperoxy cation 3A"Cs
237 HSO+ Sulfur Monoxide, S-protonated   
238 SOH+ Sulfur Monoxide, protonated   
239 H2CO Formaldehyde 1A1C2v
240 H2CO- formaldehyde anion 2A'Cs
241 H2CO+ formaldehyde cation 2B2C2v
242 H2CS Thioformaldehyde 1A1C2v
243 H2NO nitroxide 2B1C2v
244 H2NO nitroxide 2A'Cs
245 H2O2 Hydrogen peroxide 1AC2
246 H2O2 Hydrogen peroxide 1AgC2h
247 H2S2 Disulfane 1AC2
248 CH2OH Hydroxymethyl radical 2AC1
249 CH3O+ Methoxy cation 3A1C3v
250 NH2OH hydroxylamine 1A'Cs
251 NH2OH+ Hydroxylamine cation   
252 CH3OH- Methyl alcohol anion 2A'Cs
253 CH3OH- Methyl alcohol anion 2A'CS eclipsed
254 CH3SH Methanethiol 1A'Cs
255 CH3SH+ Methanethiol cation 2A"Cs
256 NH3OH+ N-protonated hydroxylamine   
257 H2OH2O water dimer 1A'Cs
258 LiCl lithium chloride 1ΣC∞v
259 NaF sodium fluoride 1ΣC∞v
260 NaCl Sodium Chloride 1ΣC∞v
261 MgF+ magnesium fluoride cation 1ΣC∞v
262 ZnF Zinc monofluoride 2ΣC∞v
263 BF Boron monofluoride 1ΣC∞v
264 ScF Scandium monofluoride 1ΣC∞v
265 GaF+ Gallium monofluoride cation 2ΣC∞v
266 GaCl+ Gallium monochloride cation 2ΣC∞v
267 CF Fluoromethylidyne 2ΠC∞v
268 SiF silicon monofluoride 2ΠC∞v
269 SiF+ silicon monofluoride cation 1ΣC∞v
270 CBr Carbon monobromide 2ΠC∞v
271 SiBr Silicon monobromide 2ΠC∞v
272 NCl nitrogen monochloride 3ΣC∞v
273 AsF Arsenic monofluoride 3ΣC∞v
274 AsCl Arsenic monochloride 3ΣC∞v
275 FO Oxygen monofluoride 2ΠC∞v
276 SF Monosulfur monofluoride 2ΠC∞v
277 SeF Selenium monofluoride 2ΠC∞v
278 SeCl Selenium monochloride 2ΠC∞v
279 F2 Fluorine diatomic 1ΣgD∞h
280 F2- flourine diatomic anion 2ΣuD∞h
281 F2+ flourine diatomic cation 2ΠgD∞h
282 ClF Chlorine monofluoride 1Σ+C∞v
283 Cl2 Chlorine diatomic 1ΣgD∞h
284 Cl2+ chlorine diatomic cation 2ΠgD∞h
285 HCF Fluoromethylene 1A'Cs
286 HCF Fluoromethylene 3A"Cs
287 HOCl+ hypochlorous acid cation   
288 ClFH+ Chlorine fluoride, F-protonated   
289 FClH+ Chlorine fluoride, Cl-protonated   
290 CH2F fluoromethyl radical 2ACs
291 CH3F Methyl fluoride 1A1C3v
292 CH3Cl Methyl chloride 1A1C3v
293 NH4Cl Ammonium chloride   
294 LiNe+ Lithium Neon cation   
295 Ne2+ Neon diatomic cation 2ΣuD∞h
296 Ar2 Argon diatomic 1SgD∞h
297 Ar2+ Argon diatomic cation 2ΣuD∞h
298 C3 carbon trimer 1ΣgD∞h
299 C3 carbon trimer 1A1C2v
300 C3H3 cyclopropenyl radical 2A'Cs
301 C3H5 Allyl radical 2A2C2v
302 C3H5 Allyl radical 2A"Cs
303 CH2CHCH3 Propene 1A'Cs
304 LiCN lithium cyanide 1ΣC*V LiCN
305 LiCN lithium cyanide 1A'Cs
306 LiCN lithium cyanide 1ΣC*V LiNC
307 NaCN Sodium Cyanide 1ΣC∞v
308 N3 azide radical 2ΠgD∞h
309 N3+ azide cation 3ΣgD∞h
310 N3+ azide cation 3ΣC∞v
311 HCCN cyanomethylene 3A"Cs
312 NH2CN cyanamide 1A1C2v
313 Li2O dilithium oxide 1ΣgD∞h
314 Li2S dilithium sulfide 1ΣGD∞h
315 Li2S dilithium sulfide 1A1C2v
316 CCO Dicarbon monoxide 3ΣC∞v
317 CCO Dicarbon monoxide 1ΠC∞v
318 NCO isocyanato radical 2ΠC∞v
319 N2O Nitrous oxide 1ΣC∞v
320 N2O- Nitrous oxide anion 2A'Cs
321 CO2 Carbon dioxide 1ΣgD∞h
322 OCS Carbonyl sulfide 1ΣC∞v
323 TiO2 Titanium dioxide 1A1C2v
324 SiS2 Silicon disulfide 1ΣGD∞h
325 CSe2 Carbon diselenide 1A1D∞h
326 NO2 Nitrogen dioxide 2A1C2v
327 NO2+ Nitrogen dioxide cation 1ΣGD∞h
328 O3 Ozone 1A1Cs
329 SO2 Sulfur dioxide 1A1C2v
330 S3 Sulfur trimer 1A1C2v
331 S3+ Sulfur trimer cation 2B2C2v
332 HCNO fulminic acid 1ΣC∞v
333 HCNO fulminic acid 1A'Cs
334 HNNO+ Nitrous oxide, N-protonated 1A'Cs
335 NNOH+ Nitrous Oxide, O-protonated 1A'Cs
336 O3H+ protonated ozone 1A'Cs
337 Be(OH)2 Beryllium hydroxide   
338 H2COO Dioxymethyl radical 2A'Cs
339 HCOOH Formic acid 1A'Cs
340 CH2BOH hydroxy(methylene)borane 1A'Cs
341 BH3CO Borane carbonyl 1A1C3v
342 CH3BO Borane, methyloxo- 1A1C3v
343 CH3NO nitrosomethane 1A'Cs
344 CuF2 Copper difluoride 2ΠgD∞h
345 CNF iso cyanogen fluoride 1ΣC∞v
346 FCO Carbonyl fluoride 2A'Cs
347 FCO+ Carbonyl fluoride cation 1ΣC∞v
348 ClCO carbonyl monochloride 2A'Cs
349 BF2 Boron difluoride radical 2A1C2v
350 FSN Thiazyl fluoride 1A'Cs
351 CF2 Difluoromethylene 1A1D∞h
352 CFCl chlorofluoromethylene 1A'Cs
353 OClO- Chlorine dioxide anion 1A'Cs
354 HFCO+ formyl fluoride cation 2A'Cs
355 C4H2 Diacetylene 1ΣgD∞h
356 C4H4 Tetrahedrane   
357 Li3N trilithium nitride 1A'D3h
358 C2N2 Cyanogen 1ΣgD∞h
359 P(CH3)3 trimethylphosphine 1A1C3v
360 C3O Tricarbon monoxide 1ΣC∞v
361 ONNO NO dimer 1Agtrans C2H
362 NH2COOH Carbamic acid 1A'Cs
363 NH2CONH2 Urea 1A1C2v
364 C3H6O Oxetane 1A'Cs
365 BF3 Borane, trifluoro- 1A'D3h
366 AlF3 Aluminum trifluoride 1A1'D3h
367 PF6- Hexafluorophosphate ion 1A1GOh

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 H+ Hydrogen atom cation h+  
6 D2 Deuterium diatomic d2  
7 H2+ Hydrogen cation h2+  
8 HD Deuterium hydride hd  
9 H3+ hydrogen trimer cation h3+  
10 He- Helium atom anion he-  
11 He+ Helium atom cation he+  
12 HeH Helium hydride heh  
13 HeH+ Helium hydride cation heh+  
14 He2+ helium diatomic cation he2+  
15 Li- Lithium atom anion li-  
16 Li+ Lithium atom cation li+  
17 Na- Sodium atom anion na-  
18 Na+ Sodium atom cation na+  
19 K Potassium atom k  
20 K- Potassium atom anion k-  
21 K+ Potassium atom cation k+  
22 Cu Copper atom cu  
23 Cu- Copper atom anion cu-  
24 Cu+ Copper atom cation cu+  
25 LiH Lithium Hydride lih  
26 LiH- lithium hydride anion lih-  
27 LiH+ lithium hydride cation lih+  
28 NaH sodium hydride nah  
29 NaH- sodium hydride anion nah-  
30 NaH+ sodium hydride cation nah+  
31 KH Potassium hydride kh  
32 KH+ Potassium hydrogen cation kh+  
33 CuH Copper monohydride cuh  
34 Be- Beryllium atom anion be-  
35 Be+ Beryllium atom cation be+  
36 Mg- Magnesium atom anion mg-  
37 Mg+ Magnesium atom cation mg+  
38 Ca Calcium atom ca  
39 Ca- Calcium atom anion ca-  
40 Ca+ Calcium atom cation ca+  
41 Zn Zinc atom zn  
42 Zn- Zinc atom anion zn-  
43 Zn+ Zinc atom cation zn+  
44 BeH beryllium monohydride beh  
45 BeH- berylium monohydride anion beh-  
46 BeH+ beryllium monohydride cation beh+  
47 MgH- magnesium monohydride anion mgh-  
48 MgH+ magnesium monohydride cation mgh+  
49 CaH Calcium monohydride cah  
50 CaH+ Calcium monohydride cation cah+  
51 TiH Titanium monohydride tih  
52 ZnH Zinc monohydride znh  
53 ZnH+ Zinc, protonated znh+  
54 BeH2 beryllium dihydride beh2  
55 BeH2+ Beryllium dihydride cation beh2+  
56 CaH2 Calcium Hydride cah2  
57 ZnH2 Zinc hydride znh2  
58 B- Boron atom anion b-  
59 Al+ Aluminum atom cation al+  
60 Sc+ Scandium cation sc+  
61 Ga Gallium atom ga  
62 Ga- Gallium atom anion ga-  
63 Ga+ Gallium atom cation ga+  
64 BH- boron monohydride anion bh-  
65 BH+ boron monohydride cation bh+  
66 AlH aluminum monohydride alh  
67 AlH- aluminum monohydride anion alh-  
68 AlH+ aluminum monohydride cation alh+  
69 ScH+ Scandium monohydride cation sch+  
70 GaH Gallium monohydride gah  
71 BH2 boron dihydride bh2  
72 BH2- boron dihydride anion bh2-  
73 BH2+ Boron dihydride cation bh2+  
74 AlH2 aluminum dihydride alh2  
75 AlH2- aluminum dihydride anion alh2-  
76 AlH2+ aluminum dihydride cation alh2+  
77 BH3 boron trihydride bh3  
78 BH3- boron trihydride anion bh3-  
79 AlH3+ aluminum trihydride cation alh3+  
80 GaH3 Gallium trihydride gah3  
81 AlH4- Aluminum tetrahydride anion alh4-  
82 C- Carbon atom anion c-  
83 C+ Carbon atom cation c+  
84 Si+ Silicon atom cation si+  
85 Ti Titanium atom ti  
86 Ti- Titanium atom anion ti-  
87 Ti+ Titanium atom cation ti+  
88 Ge Germanium atom ge  
89 Ge- Germanium anion ge-  
90 Ge+ Germanium cation ge+  
91 Sn Tin atom sn  
92 Sn+ Tin cation sn+  
93 CH Methylidyne ch  
94 CH- methylidyne anion ch-  
95 CH+ Methylidyne cation ch+  
96 SiH- silicon monohydride anion sih-  
97 SiH2 silicon dihydride sih2  
98 SiH2- silicon dihydride anion sih2-  
99 SiH2+ silicon dihydride cation sih2+  
100 GeH2- germylene anion geh2-  
101 SiH3- Silyl anion sih3-  
102 GeH3 Germyl radical geh3  
103 GeH3+ germyl cation geh3+  
104 CD4 methane-d4 cd4  
105 CH2D2 methane-d2 ch2d2  
106 CH3D methane-d ch3d  
107 CH4+ Methane cation ch4+  
108 CHD3 methane-d3 chd3  
109 SiH4+ Silane cation sih4+  
110 SnH4 Stannane snh4  
111 N- Nitrogen atom anion n-  
112 N+ Nitrogen atom cation n+  
113 P- Phosphorus atom anion p-  
114 P+ Phosphorus atom cation p+  
115 Sb Antimony atom sb  
116 NH Imidogen nh  
117 NH- Imidogen anion nh-  
118 NH+ imidogen cation nh+  
119 PH- phosphorus monohydride anion ph-  
120 PH+ phosphorus monohydride cation ph+  
121 AsH Arsenic monohydride ash  
122 AsH+ Arsenic monohydride cation ash+  
123 SbH Antimony monohydride sbh  
124 ND2 Amidogen-d2 nd2  
125 NH2- amino anion nh2-  
126 PH2 Phosphino radical ph2  
127 PH2- Phosphino anion ph2-  
128 PH2+ Phosphino cation ph2+  
129 AsH2 Arsenic dihydride ash2  
130 AsH2+ Arsenic dihydride cation ash2+  
131 ND3 Ammonia-d3 nd3  
132 AsH3 Arsine ash3  
133 AsH3+ Arsine cation ash3+  
134 SbH3 Stibine sbh3  
135 AsH4+ Arsonium ash4+  
136 NH4 Ammonium radical nh4  
137 O- Oxygen atom anion o-  
138 Cr Chromium atom cr  
139 Se Selenium atom se  
140 Se- Selenium atom anion se-  
141 Se+ Selenium atom cation se+  
142 Te Tellurium atom te  
143 Te+ Tellurium atom cation te+  
144 DO Hydroxyl-d od  
145 DS Mercapto-d ds  
146 CrH Chromium hydride crh  
147 HSe Selenium monohydride hse  
148 HSe- selenium monohydride anion hse-  
149 TeH Telluryl radical teh  
150 D2O Deuterium oxide d2o  
151 D2S Hydrogen sulfide-d2 d2s  
152 H2S- Hydrogen sulfide anion h2s-  
153 H2Se+ Hydrogen selenide cation h2se+  
154 H2Te Hydrogen Telluride h2te  
155 Mn Manganese atom mn  
156 Br Bromine atom br  
157 Br- Bromine atom anion br-  
158 Br+ Bromine atom cation br+  
159 I Iodine atom iodine  
160 I- Iodine atom anion iodine-  
161 I+ Iodine atom cation iodine+  
162 DF Hydrofluoric acid-d df  
163 HF- hydrogen fluoride anion hf-  
164 HF+ hydrogen fluoride cation hf+  
165 DCl Hydrochloric acid-d dcl  
166 HCl- hydrogen chloride anion hcl-  
167 HBr- hydrogen bromide anion hbr-  
168 HBr+ hydrogen bromide cation hbr+  
169 HI Hydrogen iodide hi  
170 HI+ Hydrogen iodide cation hi+  
171 H2F+ dihydrogen fluoride cation h2f+  
172 H2I+ Iodonium h2i+  
173 Ne- Neon atom anion ne-  
174 Ar- Argon atom anion ar-  
175 Ar+ Argon atom cation ar+  
176 Fe Iron atom fe  
177 Xe Xenon atom xe  
178 HeLi+ Helium Lithium cation heli+  
179 NeH neon hydrogen neh  
180 NeH+ neon hydrogen cation neh+  
181 XeH+ Xenon, protonated xeh+  
182 H2Ar H2 Ar dimer h2ar  
183 Co Cobalt atom cobalt  
184 Ni Nickel atom ni  
185 Li2 Lithium diatomic li2  
186 Li2- lithium diatomic anion li2-  
187 Li2+ lithium diatomic cation li2+  
188 NaLi lithium sodium lina  
189 NaLi- lithium sodium anion lina-  
190 NaLi+ lithium sodium cation lina+  
191 LiK Lithium Potassium lik  
192 NaK Sodium Potassium nak  
193 NaK+ Sodium Potassium diatomic cation nak+  
194 K2 Potassium diatomic k2  
195 Cu2 Copper diatomic cu2  
196 LiBe Lithium Beryllium libe  
197 LiMg Lithium magnesium limg  
198 NaBe Sodium Beryllium nabe  
199 NaMg Sodium Magnesium namg  
200 Be2- Beryllium diatomic anion be2-  
201 Be2+ Beryllium diatomic cation be2+  
202 Mg2 Magnesium diatomic mg2  
203 Mg2- magnesium diatomic anion mg2-  
204 Mg2+ magnesium diatomic cation mg2+  
205 Ca2 Calcium diatomic ca2  
206 LiB Lithium boride lib  
207 LiAl Lithium Aluminum lial  
208 B2 Boron diatomic b2  
209 B2- Boron diatomic anion b2-  
210 Al2 Aluminum diatomic al2  
211 Al2- aluminum diatomic anion al2-  
212 Al2+ aluminum diatomic cation al2+  
213 LiBH4 Lithium borohydride libh4  
214 Al2H6 dialane al2h6  
215 LiC Lithium Carbide lic  
216 CaC Calcium monocarbide cac  
217 BC boron monocarbide bc  
218 BC- boron monocarbide anion bc-  
219 BC+ boron monocarbide cation bc+  
220 C2- carbon diatomic anion c2-  
221 SiC silicon monocarbide sic  
222 SiC- silicon monocarbide anion sic-  
223 SiC+ silicon monocarbide cation sic+  
224 Si2 Silicon diatomic si2  
225 Si2- silcon diatomic anion si2-  
226 Si2+ silcon diatomic cation si2+  
227 GeC Germanium monocarbide gec  
228 Ge2 Germanium diatomic ge2  
229 C2H+ Ethynyl cation c2h+  
230 ZnCH2 Zinc methylene znch2  
231 CCH2 vinylidene vinylidene  
232 HCCH- acetylene anion c2h2-  
233 Si2H2 disilyne si2h2  
234 CuCH3 monomethyl copper cuch3  
235 ZnCH3 Zinc monomethyl znch3  
236 C2H3+ vinyl cation c2h3+  
237 CH3CH methylmethylene ch3ch  
238 CH2SiH2 silaethylene ch2sih2  
239 Si2H4 Disilene si2h4  
240 C2H5- Ethyl anion c2h5-  
241 C2H5+ Ethyl cation c2h5+  
242 C2H6+ ethane cation c2h6+  
243 CH3SiH3 methyl silane ch3sih3  
244 GeH3CH3 methyl germane geh3ch3  
245 C2H7+ Ethane, protonated c2h7+  
246 LiN Lithium Nitride lin  
247 LiN+ Lithium Nitride cation lin+  
248 BeN Beryllium mononitride ben  
249 BeN- Beryllium mononitride anion ben-  
250 BN- boron nitride anion bn-  
251 AlN- aluminum mononitride anion aln-  
252 AlN+ aluminum mononitride cation aln+  
253 BN+ boron nitride cation bn+  
254 AlN Aluminum nitride aln  
255 CN+ Cyano cation cn+  
256 CP Carbon monophosphide cp  
257 CP- carbon monophosphide anion cp-  
258 CP+ carbon monophosphide cation cp+  
259 SiN Silicon nitride sin  
260 SiN- silicon mononitride anion sin-  
261 SiN+ silicon mononitride cation sin+  
262 SiP- Silicon monophosphide anion sip-  
263 SiP+ Silicon monophosphide cation sip+  
264 TiN Titanium mononitride tin  
265 N2+ diatomic nitrogen cation n2+  
266 PN Phosphorus mononitride pn  
267 PN- phosphorus nitride anion pn-  
268 PN+ phosphorus nitride cation pn+  
269 P2 Phosphorus diatomic p2  
270 P2- phosphorus diatomic anion p2-  
271 P2+ phosphorus diatomic cation p2+  
272 AsN Arsenic mononitride asn  
273 AsP Arsenic monophosphide asp  
274 SbN Antimony nitride sbn  
275 As2 Arsenic diatomic as2  
276 HNB hydrogen nitrogen boron hnb  
277 HNC hydrogen isocyanide hnc  
278 HCN- Hydrogen cyanide anion hcn-  
279 HCP Phosphaethyne hcp  
280 HCP+ Phosphaethyne cation hcp+  
281 NNH Dinitrogen monohydride nnh  
282 HPO Hydrogen phosphorus oxide hpo  
283 HPO+ Hydrogen phosphorus oxide cation hpo+  
284 LiNH2 lithium amide linh2  
285 HBNH Boranimine hbnh  
286 CNH2 Aminomethylidyne radical cnh2  
287 CNH2+ N-protonated hydrogen isocyanide cnh2+  
288 H2CN Dihydrogen cyanide radical h2cn  
289 H2CN+ hydrocyanonium cation h2cn+  
290 HCNH methyleneazane hcnh  
291 HCNH+ N-protonated HCN hcnh+  
292 H2NN Isodiazene h2nn  
293 CH2NH Methanimine ch3n  
294 CHNH2 aminomethylene chnh2  
295 CHNH2+ Aminocarbene cation chnh2+  
296 CH2PH Phosphaethene ch3p  
297 BH2NH2 Boranamine bh2nh2  
298 N2H4 Hydrazine n2h4  
299 N2H4+ hydrazine cation n2h4+  
300 P2H4 Diphosphine p2h4  
301 CH3PH2 Methyl phosphine ch3ph2  
302 SiH3NH2 Silane, amino sih3nh2  
303 N2H5+ protonated hydrazine n2h5+  
304 BH3PH3 borane phosphine bh3ph3  
305 BH3NH3 borane ammonia bh3nh3  
306 CH3NH3 methyl ammonium radical ch3nh3  
307 CH3NH3+ protonated methylamine ch3nh3+  
308 CH3PH3+ methyl phosphine, protonated ch3ph3+  
309 LiO- lithium oxide anion lio-  
310 LiO+ lithium oxide cation lio+  
311 NaO- sodium oxide anion nao-  
312 NaO+ sodium oxide cation nao+  
313 KO Potassium monoxide ko  
314 KO+ Potassium monoxide cation ko+  
315 CuO Copper Monoxide cuo  
316 LiSe Lithium monoselenide lise  
317 BeO beryllium oxide beo  
318 BeO- Beryllium monoxide anion beo-  
319 BeO+ Beryllium monoxide cation beo+  
320 BeS beryllium sulfide bes  
321 MgO magnesium oxide mgo  
322 MgO- magnesium oxide anion mgo-  
323 MgO+ magnesium oxide cation mgo+  
324 CaO Calcium monoxide cao  
325 MgS magnesium sulfide mgs  
326 MgS- magnesium sulfide anion mgs-  
327 MgS+ magnesium sulfide cation mgs+  
328 CaS Calcium sulfide cas  
329 ZnO zinc monoxide zno  
330 ZnS Zinc sulfide zns  
331 BeS- Beryllium monosulfide anion bes-  
332 BeS+ Beryllium monosulfide cation bes+  
333 BO- boron monoxide anion bo-  
334 AlO Aluminum monoxide alo  
335 AlO- Aluminum monoxide anion alo-  
336 AlO+ aluminum monoxide cation alo+  
337 BS boron sulfide bs  
338 BS- boron monosulfide anion bs-  
339 BS+ boron monosulfide cation bs+  
340 AlS Aluminum sulfide als  
341 AlS- aluminum monosulfide anion als-  
342 AlS+ aluminum monosulfide cation als+  
343 GaO Gallium monoxide gao  
344 GaS Gallium monosulfide gas  
345 BO+ boron monoxide cation bo+  
346 CS carbon monosulfide cs  
347 CS- carbon monosulfide anion cs-  
348 CS+ carbon monosulfide cation cs+  
349 SiO Silicon monoxide sio  
350 SiO- silicon monoxide anion sio-  
351 SiO+ silicon monoxide cation sio+  
352 SiS silicon monosulfide sis  
353 SiS- silicon monosulfide anion sis-  
354 SiS+ silicon monosulfide cation sis+  
355 CSe Carbon monoselenide cse  
356 CSe- Carbon monoselenide anion cse-  
357 CSe+ Carbon monoselenide cation cse+  
358 GeO Germanium monoxide geo  
359 GeSe Germanium monoselenide gese  
360 NS- nitrogen sulfide anion ns-  
361 NS+ nitrogen sulfide cation ns+  
362 PO- phosphorus monoxide anion po-  
363 PO+ phosphorus monoxide cation po+  
364 PS- phosphorus monosulfide anion ps-  
365 PS+ phosphorus monosulfide cation ps+  
366 AsO Arsenic monoxide aso  
367 O2-- dioxygen dianion o2--  
368 O2+ diatomic oxygen cation o2+  
369 SO Sulfur monoxide so  
370 SO- sulfur monoxide anion so-  
371 S2- sulfur diatomic anion s2-  
372 S2+ sulfur diatomic cation s2+  
373 SeO Selenium monoxide seo  
374 SeO- selenium monoxide anion seo-  
375 SeO+ selenium monoxide cation seo+  
376 SeS Selenium monosulfide ses  
377 SeS- selenium monosulfide anion ses-  
378 SeS+ selenium monosulfide cation ses+  
379 TeO Tellurium monoxide teo  
380 Se2 Selenium diatomic se2  
381 Se2- selenium diatomic anion se2-  
382 Se2+ selenium diatomic cation se2+  
383 Te2 Tellurium diatomic te2  
384 NaOH sodium hydroxide naoh  
385 KOH Potassium hydroxide koh  
386 MgOH magnesium hydroxide mgoh  
387 CaOH Calcium monohydroxide caoh  
388 HBS hydrogen boron sulfide hbs  
389 HCO Formyl radical hco  
390 HCO+ Formyl cation hco+  
391 HCS Thioformyl radical hcs  
392 HCS- Thioformyl anion hcs-  
393 HCS+ Thioformyl cation hcs+  
394 HNO Nitrosyl hydride hno  
395 HNO- Nitrosyl hydride anion hno-  
396 HNS Sulfur imide hns  
397 HNS- Sulfur imide anion hns-  
398 HO2- Hydroperoxy anion ho2-  
399 SOH Sulfur Hydroxide soh  
400 HS2 Thiosulfeno radical hs2  
401 HOCH hydroxycarbene hoch  
402 H2CS- thioformaldehyde anion h2cs-  
403 H2CS+ thioformaldehyde cation h2cs+  
404 H2CSe Selenoformaldehyde h2cse  
405 H2O2+ Hydrogen peroxide cation h2o2+  
406 H2OO water oxide h2oo  
407 HOSH hydrogen thioperoxide hosh  
408 H2S2+ hydrogen disulfide cation h2s2+  
409 H2Se2 hydrogen diselenide h2se2  
410 CH2OH+ hydroxymethyl cation ch2oh+  
411 CH3O Methoxy radical ch3o  
412 CH3O- methoxy anion ch3o-  
413 CH3S thiomethoxy ch3s  
414 H2CSH+ Thioformaldehyde, protonated h2csh+  
415 NH3O Ammonia Oxide nh3o  
416 H2POH Phosphinous acid h2poh  
417 H3PO Phosphine oxide h3po  
418 NH2SH Thiohydroxylamine nh2sh  
419 NH3S sulfidoazane nh3s  
420 H3O2+ hydrogen peroxide, protonated h3o2+  
421 CH3OH Methyl alcohol ch3oh  
422 CH3OH+ Methyl alcohol cation ch3oh+  
423 SiH3OH silanol sih3oh  
424 CH3SeH Methane selenol ch3seh  
425 NH2OH2+ protonated hydroxylamine nh2oh2+  
426 CH3OH2+ Methanol, protonated ch3oh2+  
427 CH3SH2+ protonated methylsulfide ch3sh2+  
428 H2ONH3 Water Ammonia Dimer h2onh3  
429 H5O2+ Dihydroxonium ion h5o2+  
430 LiF lithium fluoride lif  
431 LiCl- lithium chloride anion licl-  
432 LiCl+ lithium chloride cation licl+  
433 NaF- sodium fluoride anion naf-  
434 NaF+ sodium fluoride cation naf+  
435 KF Potassium Fluoride kf  
436 NaCl- sodium chloride anion nacl-  
437 NaCl+ sodium chloride cation nacl+  
438 KCl Potassium Chloride kcl  
439 CuF Copper monofluoride cuf  
440 LiBr Lithium Bromide libr  
441 LiBr- lithium bromide anion libr-  
442 LiBr+ lithium bromide cation libr+  
443 CuCl Copper monochloride cucl  
444 NaBr Sodium Bromide nabr  
445 NaBr- sodium bromide anion nabr-  
446 NaBr+ sodium bromide cation nabr+  
447 KBr Potassium Bromide kbr  
448 LiI Lithium Iodide lii  
449 NaI Sodium Iodide nai  
450 KI Potassium Iodide ki  
451 LiF- lithium fluoride anion lif-  
452 LiF+ lithium fluoride cation lif+  
453 BeF Beryllium monofluoride bef  
454 BeF- Beryllium monofluoride anion bef-  
455 BeF+ Beryllium monofluoride cation bef+  
456 BeCl beryllium monochloride becl  
457 MgF Magnesium monofluoride mgf  
458 MgF- magnesium fluoride anion mgf-  
459 CaF Calcium monofluoride caf  
460 MgCl magnesium monochloride mgcl  
461 MgCl- magnesium monochloride anion mgcl-  
462 MgCl+ magnesium monochloride cation mgcl+  
463 CaCl calcium monochloride cacl  
464 TiCl Titanium Monochloride ticl  
465 ZnF- Zinc monofluoride anion znf-  
466 ZnF+ Zinc monofluoride cation znf+  
467 ZnCl Zinc monochloride zncl  
468 CaBr Calcium monobromide cabr  
469 BeCl- beryllium monochloride anion becl-  
470 BeCl+ beryllium monochloride cation becl+  
471 BF- Boron monofluoride anion bf-  
472 BF+ Boron monofluoride cation bf+  
473 AlF Aluminum monofluoride alf  
474 AlF- Aluminum monofluoride anion alf-  
475 AlF+ Aluminum monofluoride cation alf+  
476 BCl boron monochloride bcl  
477 BCl- boron monochloride anion bcl-  
478 BCl+ boron monochloride cation bcl+  
479 AlCl Aluminum monochloride alcl  
480 AlCl- aluminum monochloride anion alcl-  
481 AlCl+ aluminum monochloride cation alcl+  
482 BBr Boron monobromide bbr  
483 GaF Gallium monofluoride gaf  
484 AlBr Aluminum monobromide albr  
485 GaCl Gallium monochloride gacl  
486 AlI Aluminum monoiodide ali  
487 GaBr Gallium monobromide gabr  
488 CF- carbon monofluoride anion cf-  
489 CF+ carbon monofluoride cation cf+  
490 CCl carbon monochloride ccl  
491 CCl- carbon monochloride anion ccl-  
492 CCl+ carbon monochloride cation ccl+  
493 SiF- silicon monofluoride anion sif-  
494 SiCl Clorosilylidyne sicl  
495 SiCl- silicon monochloride anion sicl-  
496 SiCl+ silicon monochloride cation sicl+  
497 GeF Germanium monofluoride gef  
498 GeF+ Germanium monofluoride cation gef+  
499 GeCl Germanium monochloride gecl  
500 GeCl+ Germanium monochloride cation gecl+  
501 SiBr+ Silicon monobromide cation sibr+  
502 NF nitrogen fluoride nf  
503 NF- nitrogen monofluorine anion nf-  
504 NF+ nitrogen monofluoirde cation nf+  
505 NCl- nitrogen monochloride anion ncl-  
506 NCl+ nitrogen monochloride cation ncl+  
507 PF phosphorus monofluoride pf  
508 PF- phosphorus monofluoride anion pf-  
509 PF+ phosphorus monofluoride cation pf+  
510 PCl phosphorus chloride pcl  
511 PCl- phosphorus monochloride anion pcl-  
512 PCl+ phosphorus monochloride cation pcl+  
513 NBr nitrogen monobromide nbr  
514 PBr Phosphorus monobromide pbr  
515 SbF Antimony monofluoride sbf  
516 SbCl Antimony monochloride sbcl  
517 FO- flourine oxide anion fo-  
518 FO+ fluorine monoxide cation fo+  
519 ClO Monochlorine monoxide clo  
520 ClO- chlorine monoxide anion clo-  
521 ClO+ chlorine monoxide cation clo+  
522 SF- sulfur monofluoride anion sf-  
523 SF+ sulfur monofluoride cation sf+  
524 SCl sulfur monochloride scl  
525 SCl- sulfur monochloride anion scl-  
526 SCl+ sulfur monochloride cation scl+  
527 BrO Bromine monoxide bro  
528 BrO- Bromine monoxide anion bro-  
529 BrO+ Bromine monoxide cation bro+  
530 SBr Sulfur monobromide radical sbr  
531 SBr+ Sulfur monobromide cation sbr+  
532 IO Iodine monoxide io  
533 SeBr Selenium monobromide sebr  
534 BrCl Bromine monochloride brcl  
535 ClF- clorine monofluoride anion clf-  
536 ClF+ clorine monofluoride cation clf+  
537 Cl2- chlorine diatomic anion cl2-  
538 BrF Bromine monofluoride brf  
539 BrF- bromine fluoride anion brf-  
540 BrF+ bromine fluoride cation brf+  
541 BrCl- bromine chloride anion brcl-  
542 BrCl+ bromine chloride cation brcl+  
543 IF Iodine monofluoride if  
544 Br2 Bromine diatomic br2  
545 Br2- bromine diatomic anion br2-  
546 Br2+ bromine diatomic cation br2+  
547 ICl Iodine monochloride icl  
548 IBr Iodine monobromide ibr  
549 I2 Iodine diatomic i2  
550 I2+ Iodine diatomic cation i2+  
551 HCCl Chloromethylene hccl  
552 HSiF fluorosilylene hsif  
553 HSiCl Chlorosilylene hsicl  
554 HSiBr monobromosilylene hsibr  
555 CHBr bromomethylene chbr  
556 HOF Hypofluorous acid hfo  
557 DOCl Hypochlorous acid-d docl  
558 HOCl hypochlorous acid hocl  
559 HOBr Hypobromous acid hobr  
560 HOBr+ Hypobromous acid cation hobr+  
561 HOI Hypoiodous acid hoi  
562 F2H+ Fluorine, protonated f2h+  
563 FHF Hydrogen difluoride fhf  
564 FHF- Hydrogen difluoride anion fhf-  
565 Cl2H+ Chlorine, protonated cl2h+  
566 CH2Br bromomethyl radical ch2br  
567 CH2F+ fluoromethyl cation ch2f+  
568 CH2Cl+ chloromethyl cation ch2cl+  
569 CH2Cl chloromethyl radical ch2cl  
570 NH2F monofluoroamine nh2f  
571 NH2Cl chloramine nh2cl  
572 H2F2 Hydrogen fluoride dimer h2f2  
573 CH3F+ methyl fluoride cation ch3f+  
574 CD3F methylfluoride-d3 cd3f  
575 CD3Cl methyl chloride d3 cd3cl  
576 CH3Cl+ Methyl chloride cation ch3cl+  
577 SiH3F monofluorosilane sih3f  
578 SiH3Cl chlorosilane sih3cl  
579 CH3Br methyl bromide ch3br  
580 GeH3F monofluorogermane geh3f  
581 GeH3Cl monochlorogermane geh3cl  
582 SiH3Br bromosilane sih3br  
583 CH3I methyl iodide ch3i  
584 SiH3I Silyl Iodide sih3i  
585 NH3Cl+ protonated monochloroammonia nh3cl+  
586 CH3ClH+ methyl chloride, protonated ch3clh+  
587 Ne2 Neon diatomic ne2  
588 Li3 Lithium trimer li3  
589 C3+ carbon trimer cation c3+  
590 SiC2 Silicon dicarbide sic2  
591 C3H3 Propargyl radical propargyl  
592 C3H3- Propargyl anion c3h3-  
593 C3H3+ cyclopropenyl cation cpr+  
594 C3H3+ Propargyl cation c3h3+  
595 C3H4 cyclopropene cprop  
596 CH2CCH2 allene allene  
597 CH3CCH propyne propyne  
598 C3H5+ Allyl cation allyl+  
599 CH3CHCH 1-propenyl radical ch3chch  
600 Zn(CH3)2 dimethyl zinc dmz  
601 C3H6 Cyclopropane c3h6  
602 C3H7 n-Propyl radical npropyl  
603 C3H7+ cyclopropane, protonated c3h7+  
604 CH3CHCH3 Isopropyl radical isopropyl  
605 CH3CHCH3+ Isopropyl cation prop2yl+  
606 C3H8 Propane propane  
607 SiH2(CH3)2 dimethylsilane dms  
608 Si3H8 trisilane si3h8  
609 KCN Potassium cyanide kcn  
610 CuCN Copper cyanide cucn  
611 ZnCN Zinc monocyanide zncn  
612 ZnNC Zinc isocyanide znnc  
613 AlCN Aluminum monocyanide alcn  
614 AlNC Aluminum isocyanide alnc  
615 CN2 3H-Diazirin-3-ylidene cn2  
616 CNN Diazocarbene cnn  
617 NCN Cyanoimidogen ncn  
618 N3- azide anion n3-  
619 HCNN diazomethyl radical hcnn  
620 HN3 hydrogen azide hn3  
621 HN3+ Hydrazoic acid cation hn3+  
622 HNCNH diiminomethane hncnh  
623 CH2N2 diazirine ch2n2  
624 CH2NN diazomethane ch2nn  
625 HNNNH+ 1,2-Triazadienium n2h3+  
626 NH2NN+ hydrazoic acid, protonated nh2nn+  
627 CH3CN Acetonitrile ch3cn  
628 CH3CN- acetonitrile anion ch3cn-  
629 CH3CN+ Acetonitrile cation ch3cn+  
630 CH3NC methyl isocyanide ch3nc  
631 CHNCH2 2H-Azirine c157164  
632 CHNHCH 1H-Azirine chnhch  
633 H2CCNH Ethenimine ch2cnh  
634 H2CNCH methyleneaminomethylene ch2nch  
635 HCCNH2 Ethynamine hccnh2  
636 HCNCH2+ 2H-Azirine cation hcnch2+  
637 HNCNH2+ diiminomethane, protonated hncnh2+  
638 NCNH3+ Cyanamide, protonated ncnh3+  
639 NH2CNH+ cyanamide, cn protonated nh2cnh+  
640 NH3CN+ cyanamide, amine protonated nh3cn+  
641 CH2CHNH vinylazine ch2chnh  
642 CH3CHN methylmethaniminyl radical ch3chn  
643 NHCHNH2 aminomethanimine cn2h4  
644 C2H5N Aziridine c2h5n  
645 CH2CHNH2 aminoethene aminoethene  
646 CH2NCH3 N-methylmethanimine nmm  
647 CH3CHNH ethanimine ethanimine  
648 NH2BHNH2 diaminoborane nh2bhnh2  
649 C2H5NH+ Protonated Aziridine c2h5nh+  
650 C2H6N+ aziridine, protonated c2h6n+  
651 NH2CH2NH2 diaminomethane nh2ch2nh2  
652 CH3CH2NH2 Ethylamine etam  
653 CH3NHCH3 Dimethylamine ch3nhch3  
654 CH3PHCH3 dimethylphosphine ch3phch3  
655 NH2CH2NH3+ diaminoethane, protonated pdam  
656 (CH3)2NH2+ dimethylammonium cation dmam  
657 CH3CH2NH3+ ethylamine, protonated pea  
658 Li2O+ dilithium oxide cation li2o+  
659 Na2S Sodium sulfide na2s  
660 LiO2 Lithium dioxide lio2  
661 NaO2 Sodium superoxide nao2  
662 CNO- fulminate cno-  
663 NCO- cyanate nco-  
664 SCN thiocyanato radical scn  
665 SCN- thiocyanide anion scn-  
666 BO2 Boron dioxide bo2  
667 BO2- Boron dioxide anion bo2-  
668 BO2+ Boron dioxide cation bo2+  
669 N2O+ Nitrous oxide cation n2o+  
670 NNS Nitrogen sulfide nns  
671 PPO Phosphorus oxide phosphide ppo  
672 CO2- Carbon dioxide anion co2-  
673 CO2+ Carbon dioxide cation co2+  
674 OCS+ Carbonyl sulfide cation cos+  
675 SiO2 silicon dioxide sio2  
676 CS2 Carbon disulfide cs2  
677 CS2- Carbon disulfide anion cs2-  
678 CS2+ Carbon disulfide cation cs2+  
679 GeO2 Germanium dioxide geo2  
680 OCSe Carbonyl selenide ocse  
681 SCSe Carbon sulfide selenide scse  
682 GeS2 Germanium disulfide ges2  
683 SCTe Carbon sulfide Telluride scte  
684 NO2- Nitrogen dioxide anion no2-  
685 NSO sulfinyl amidogen NSO  
686 PO2 Phosphorus dioxide po2  
687 PO2- Phosphorus dioxide anion po2-  
688 PO2+ Phosphorus dioxide cation po2+  
689 SNO Nitrogen oxide sulfide sno  
690 AsO2 Aresenic dioxide aso2  
691 O3- Ozone anion o3-  
692 O3+ Ozone cation o3+  
693 SO2- Sulfur dioxide anion so2-  
694 SO2+ Sulfur dioxide cation so2+  
695 SSO Disulfur monoxide sso  
696 S3- Sulfur trimer anion s3-  
697 SeO2 Selenium dioxide seo2  
698 SeO2+ Selenium dioxide cation seo2+  
699 TeO2 Tellurium Dioxide teo2  
700 HCCO ketenyl radical ketenyl  
701 CS2H+ Carbon disulfide, protonated cs2h+  
702 HNCO Isocyanic acid hnco  
703 HOCN cyanic acid hocn  
704 HNCS Isothiocyanic acid hncs  
705 HSCN thiocyanic acid hscn  
706 HCO2- formate anion hco2-  
707 HNNO nitrosoazane hnno  
708 HCOO formate neutral radical hcoo  
709 HOCO Hydrocarboxyl radical hoco  
710 HOCO+ Hydrocarboxyl cation hoco+  
711 HNO2 Nitrous acid hno2  
712 HNO2+ nitrous acid cation hno2+  
713 SO2H+ protonated sulfur dioxide so2h+  
714 C2H2O Oxirene oxirene  
715 CH2CO Ketene ch2co  
716 CH2CO+ Ketene cation ch2co+  
717 HCCOH ethynol hccoh  
718 CH2CS Thioketene ch2cs  
719 Mg(OH)2 Magnesium dihydroxide h2mgo2  
720 NH2NO Nitrosamide nh2no  
721 CH2O2 Dioxirane diox  
722 H2COO+ dioxymethyl cation h2coo+  
723 H2O3 Hydrogen trioxide h2o3  
724 HSSSH trisulfane hsssh  
725 NaOCH3 Sodium methoxide naoch3  
726 CH2CHO Vinyloxy radical ch2cho  
727 CH2COH+ ketene, protonated ch2coh+  
728 CH3CO Acetyl radical ch3co  
729 CH3CO- Acetyl anion ch3co-  
730 CH3CO+ acetyl cation ch3co+  
731 CH2NOH formaldoxime ch2noh  
732 CHONH2 formamide formamide  
733 CNOH3 1,2-oxaziridine cnoh3  
734 HOCHNH hydroxymethylimine hochnh  
735 CHSNH2 thioformamide chsnh2  
736 NHCHSH Methanimidothioic acid nhchsh  
737 CH2OOH CH2OOH radical ch2ooh  
738 CH3OO methylperoxy radical ch3oo  
739 CH3OO- methylperoxy anion ch3oo-  
740 CH3OO+ methylperoxy cation ch3oo+  
741 C2H4O Ethylene oxide c2h4o  
742 C2H4O+ ethylene oxide cation c2h4o+  
743 CH2CHOH ethenol ch2choh  
744 CH3CHO Acetaldehyde ch3cho  
745 CH3CHO+ acetaldehyde cation ch3cho+  
746 H2COCH2+ Methyl, (methyleneoxoniumyl)- h2coch2+  
747 C2H4S Thiirane thiirane  
748 CH2CHSH Ethenethiol ch2chsh  
749 CH3CHS Thioacetaldehyde ch3chs  
750 H2CONH2+ protonated formamide h2conh2+  
751 NH2CHOH+ Formamide, O-protonated nh2choh+  
752 NH3CHO+ Formamide, N-Protonated nh3cho+  
753 CH2(OH)2 methanediol ch2o2h2  
754 CH3OOH Methyl peroxide ch3ooh  
755 CH3SSH Hydrogen methyl disulfide ch3ssh  
756 HSCH2SH Methanedithiol ch4s2  
757 H2OH2CO water formaldehyde dimer h2oh2co  
758 C2H4OH+ ethylene oxide, protonated c2h4oh+  
759 CH2CH2OH 2-hydroxy ethyl radical ch2ch2oh  
760 CH3CH2O Ethoxy radical ethoxy  
761 CH3CHOH 1-hydroxy-ethyl radical ch3choh  
762 CH3CHOH+ acetaldehyde, protonated ch3choh+  
763 CH3OCH2 methoxymethyl radical ch3och2  
764 NH2CH2OH aminomethanol nh2ch2oh  
765 CH3CH2OH Ethanol etoh  
766 CH3OCH3 Dimethyl ether meome  
767 CH3CH2SH ethanethiol etsh  
768 CH3SCH3 Dimethyl sulfide mesme  
769 CH3SCH3+ dimethyl sulfide cation mesme+  
770 CH3SeCH3 dimethylselenide dmse  
771 CH3OHH2O methanol water dimer ch3ohh2o  
772 H2OCH3OH water methanol dimer h2och3oh  
773 ZnF2 Zinc difluoride znf2  
774 FCN Cyanogen fluoride fcn  
775 ClCN chlorocyanogen clcn  
776 BrCN Cyanogen bromide brcn  
777 ICN Cyanogen iodide icn  
778 FBO Boron monofluoride monoxide fbo  
779 BeF2 Beryllium fluoride bef2  
780 MgF2 Magnesium fluoride mgf2  
781 BeCl2 Beryllium chloride becl2  
782 MgCl2 Magnesium dichloride mgcl2  
783 CaCl2 Calcium Chloride cacl2  
784 ZnCl2 Zinc dichloride zncl2  
785 BeBr2 Beryllium bromide bebr2  
786 CaBr2 Calcium dibromide cabr2  
787 CaF2 Calcium difluoride caf2  
788 FNO Nitrosyl fluoride fno  
789 ClNO Nitrosyl chloride clno  
790 FNS Thionitrosyl fluoride fns  
791 OPCl Phosphorus oxychloride opcl  
792 BrNO Nitrosyl bromide brno  
793 INO Nitrosyl iodide ino  
794 CF2- Difluoromethylene anion cf2-  
795 CF2+ Difluoromethylene cation cf2+  
796 SiF2 Silicon difluoride sif2  
797 SiF2+ Silicon difluoride cation sif2+  
798 CCl2 dichloromethylene ccl2  
799 CCl2- dichloromethylene anion ccl2-  
800 CCl2+ dichloromethylene cation ccl2+  
801 SiCl2 Dichlorosilylene sicl2  
802 GeF2 Germanium difluoride gef2  
803 GeCl2 Germanium dichloride gecl2  
804 CBr2 dibromomethylene cbr2  
805 FOO Dioxygen monofluoride radical foo  
806 FOO+ Fluorine dioxide cation foo+  
807 ClOO chloroperoxy radical cloo  
808 ClOO+ chloroperoxy cation cloo+  
809 OClO Chlorine dioxide oclo  
810 OClO+ Chlorine dioxide cation oclo+  
811 ClSO Sulfur chloride oxide clso  
812 ClS2 Sulfur chloride cls2  
813 BrOO Bromine dioxide broo  
814 OBrO Bromine dioxide radical obro  
815 NF2 Difluoroamino radical nf2  
816 NF2+ Difluoroamino cation nf2+  
817 PF2 Phosphorus difluoride pf2  
818 PF2+ Phosphorus difluoride cation pf2+  
819 FClO chlorosyl fluoride fclo  
820 F2O Difluorine monoxide f2o  
821 ClOF Chlorine hypofluorite clof  
822 SF2 sulfur difluoride sf2  
823 SF2- sulfur difluoride anion sf2-  
824 SF2+ sulfur difluoride cation sf2+  
825 Cl2O Dichlorine monoxide cl2o  
826 SCl2 Sulfur dichloride scl2  
827 SeF2 Selenium difluoride sef2  
828 BrOCl Bromine hypochlorite brocl  
829 SeCl2 Selenium Dichloride secl2  
830 SBr2 Sulfur dibromide sbr2  
831 SeBr2 Selenium dibromide sebr2  
832 BrOBr Bromine oxide brobr  
833 F3- trifluoride anion f3-  
834 Cl3- trichloride anion cl3-  
835 Br3- tribromide anion br3-  
836 I3- triiodide i3-  
837 SFCl Sulfur chloride fluoride sfcl  
838 HCCF Fluoroacetylene hccf  
839 HCCF+ fluoroacetylene cation hccf+  
840 HCCCl Chloroacetylene hcccl  
841 HCCBr bromoacetylene hccbr  
842 HFCO formyl fluoride hfco  
843 COHCl Formyl chloride cohcl  
844 COHBr Formyl bromide cohbr  
845 BHF2 Difluoroborane bhf2  
846 BHCl2 Borane, dichloro- bhcl2  
847 CHCl2 dichloromethyl radical chcl2  
848 CHF2 difluoromethyl radical chf2  
849 CHF2+ difluoromethyl cation chf2+  
850 CHFCl Chlorofluoromethyl radical chfcl  
851 CHFCl+ Chlorofluoromethyl cation chfcl+  
852 CHCl2+ dichloromethyl cation chcl2+  
853 CHBr2 dibromomethyl radical chbr2  
854 HOClO Chlorous acid hoclo  
855 NHF2 difluoramine nhf2  
856 NHCl2 dichloroamine nhcl2  
857 CH2F2 Methane, difluoro- ch2f2  
858 CH2FCl fluorochloromethane ch2fcl  
859 SiH2F2 difluorosilane sih2f2  
860 CH2Cl2 Methylene chloride ch2cl2  
861 CH2BrF Methane, bromofluoro- ch2fbr  
862 CH2BrCl Methane, bromochloro- ch2clbr  
863 CH2FI fluoroiodomethane ch2fi  
864 CH2Br2 dibromomethane ch2br2  
865 CH2ClI chloroiodomethane ch2cli  
866 CH2BrI bromoiodomethane ch2bri  
867 CH2I2 Diiodomethane ch2i2  
868 SiH2Cl2 dichlorosilane sih2cl2  
869 CH3MgBr Methyl Magnesium Bromide ch3mgbr  
870 CH2CHF Ethene, fluoro- ch2chf  
871 CH2CHF+ fluoroethene cation ch2chf+  
872 C2H3Cl Ethene, chloro- ch2chcl  
873 C2H3Br vinyl bromide c2h3br  
874 C2H3I Vinyl iodide c2h3i  
875 CH2FOH fluoromethanol ch2foh  
876 CH3OCl methyl hypochlorite ch3ocl  
877 CH2CH2Cl 2-chloroethyl radical ch2ch2cl  
878 CHClCH3 1-chloroethyl radical chclch3  
879 C2H5F fluoroethane c2h5f  
880 CH3CH2Cl Ethyl chloride c2h5cl  
881 CH3SiFH2 fluoromethylsilane ch3sifh2  
882 C2H5Br Ethyl bromide etbr  
883 C2H5I Ethyl iodide c2h5i  
884 KrF2 Krypton difluoride krf2  
885 XeF2 Xenon difluoride xef2  
886 B4H10 Tetraborane(10) b4h10  
887 C4 Carbon tetramer c4  
888 C4+ Carbon tetramer cation c4+  
889 C4H2+ diacetlyene cation c4h2+  
890 C2H3CCH 1-Buten-3-yne c2h3cch  
891 C4H4 cyclobutadiene cbd  
892 H2CCCCH2 Butatriene h2cccch2  
893 C4H6 1-Methylcyclopropene c3100047  
894 C4H6 Cyclobutene c822355  
895 C4H6 Methylenecyclopropane c6142730  
896 CH2CCHCH3 1,2-Butadiene butad12  
897 CH2CHCHCH2 1,3-Butadiene c106990  
898 CH3CCCH3 2-Butyne c503173  
899 CHCCH2CH3 1-Butyne c107006  
900 CH3CHCHCH2 methylallyl radical c4h7  
901 C4H8 methylcyclopropane mcp  
902 CH2C(CH3)CH3 1-Propene, 2-methyl- isobute  
903 CH2CHCH2CH3 1-Butene bute1  
904 CH3CHCHCH3 2-Butene, (E)- bute2e  
905 CH3CHCHCH3 2-Butene, (Z)- bute2z  
906 B(CH3)3 trimethylborane bme3  
907 Al(CH3)3 trimethyl aluminum tma  
908 C(CH3)3 Tert-butyl radical tbutyl  
909 CH2CH(CH3)2 Isobutyl radical isobutyl  
910 CH3CHCH2CH3 2-Butyl radical butyl2  
911 CH3CH(CH3)CH3 Isobutane isobutane  
912 CH3CH2CH2CH3 Butane butane  
913 SiH(CH3)3 trimethylsilane trimsi  
914 C2N2+ Cyanogen cation c2n2+  
915 P4 Phosphorus tetramer p4  
916 As4 Arsenic tetramer as4  
917 HCCCN Cyanoacetylene hcccn  
918 HCCCN+ Cyanoacetylene cation hcccn+  
919 H2CNCN cyanamide, methylene ch2ncn  
920 HNCCNH Ethenediimine hnccnh  
921 C3H3N acrylonitrile ch2chcn  
922 C3H3N+ acrylonitrile cation ch2chcn+  
923 CH3N3 methyl azide ch3n3  
924 NH2CCNH2 Diaminoacetylene daa  
925 NH2CH2CN Aminoacetonitrile aan  
926 CH3NHN2+ methyl azide, protonated ch3nhn2+  
927 C2H5CN ethyl cyanide c2h5cn  
928 CH5N3 Guanidine guanidine  
929 C4H6 Bicyclo[1.1.0]butane c157335  
930 CH3NNCH3 (Z)-1,2-Dimethyldiazene dmdiazz  
931 H2NCHCHNH2 diaminoethylene dae  
932 CH6N3+ guanidinium ch6n3+  
933 C3H7N Cyclopropylamine cpram  
934 CH7N3 triaminomethane tam  
935 C3H7N Azetidine azet  
936 C4H8 cyclobutane cbutane  
937 C2H8N2 Ethylenediamine ethdiam  
938 CH3NHNHCH3 dimethyl hydrazine dmh  
939 CH3CH(NH2)CH3 2-Propanamine pram2  
940 N(CH3)3 Trimethylamine trimeam  
941 NH2CH2CH2CH3 1-Propanamine pram1  
942 N(SiH3)3 trisilylamine tsa  
943 As(CH3)3 trimethyl arsine tmas  
944 (CH3)3NH+ protonated trimethyl amine ptma  
945 C3H7NH3+ n-propylamine, protonated c3h7nh2  
946 Li2O2 dilithium dioxide li2o2  
947 Na2O2 disodium dioxide na2o2  
948 K2O2 dipotassium dioxide k2o2  
949 B2O2 Diboron dioxide b2o2  
950 S2N2 Disulfur dinitride s2n2  
951 CO3 Carbon trioxide co3  
952 CO3-- carbonate co3--  
953 CS3-- Carbonotrithioate cs3--  
954 NO3 Nitrogen trioxide no3  
955 NO3- nitrate anion no3-  
956 NO3+ nitrogen trioxide cation no3+  
957 SO3 Sulfur trioxide so3  
958 SO3- Sulfur trioxide anion so3-  
959 SO3-- Sulfate dianion so3--  
960 SO3+ Sulfur trioxide cation so3+  
961 SeO3 selenium trioxide seo3  
962 S4 Sulfur tetramer s4  
963 TeO3 Tellurium trioxide teo3  
964 HCO3- bicarbonate anion hco3-  
965 HNO3 Nitric acid hno3  
966 HSO3 Hydroxysulfonyl radical hso3  
967 NH2NO2 nitramide nh2no2  
968 C2H2CO cyclopropenone c2h2co  
969 C3H2O Propadienal c3h2o  
970 HCCCHO 2-propynal hcccho  
971 C2H2O2 Ethanedial c2h2o2  
972 C2H2O2+ Ethanedial cation c2h2o2+  
973 H2CO3 Carbonic acid h2co3  
974 H2CS3 thiocarbonic acid h2cs3  
975 H2NO3+ Nitric Acid, Protonated h2no3+  
976 H2SO3 Sulfurous acid h2so3  
977 C2H3NO Nitrosoethylene c2h3no  
978 CH3NCO methylisocyante ch3nco  
979 HOCH2CN cyanomethanol hoch2cn  
980 CH3COO- acetate anion ch3coo-  
981 CH3NO2 Methane, nitro- ch3no2  
982 CH3ONO Methyl nitrite ch3ono  
983 H3BO3 Boric acid h3bo3  
984 H3AlO3 Aluminum hydroxide h3alo3  
985 H3CO3+ carbonic acid, protonated h3co3+  
986 C3H4O 2-Propyn-1-ol c107197  
987 C3H4O allenol c9000071  
988 C3H4O Cyclopropanone cpone  
989 C3H4O Methylketene c6004440  
990 CH2CHCHO Acrolein c3h4o  
991 NH2CONH2+ Urea cation urea+  
992 NH2CSNH2 Thiourea thiourea  
993 C2H4O2 1,3-dioxetane c2h4o2  
994 CH3COOH Acetic acid ch3cooh  
995 CH3OCHO methyl formate ch3ocho  
996 CHOCH2OH hydroxy acetaldehyde haa  
997 NH2COOH2+ Carbamic acid, O-protonated nh2cooh2+  
998 NH3COOH+ protonated Carbamic acid nh3cooh+  
999 H2OHCOOH Water formic acid dimer 1 h2ohcooh_10  
1000 H2OHCOOH Water formic acid dimer 2 h2ohcooh_11  
1001 HCOOHH2O Formic acid water dimer hcoohh2o  
1002 HOCH2OOH hydroxy methyl peroxide hoch2ooh  
1003 CH3COCH2 Acetonyl radical ch3coch2  
1004 CH2C(OH)NH2 1-amino vinyl alchohol ava  
1005 CH3C(OH)=NH Ethaninidic acid eia  
1006 CH3CHNOH Acetaldoxime acetaldoxime  
1007 CH3CONH2 Acetamide acetamide  
1008 HCONHCH3 N-methylformamide nmfa  
1009 CH3CSNH2 Ethanethioamide ch3csnh2  
1010 CH5N2O+ urea, N-protonated ch4n2o+  
1011 H2NCOHNH2+ urea, protonated ureah+  
1012 C2H5OO ethylperoxy radical c2h5oo  
1013 CH3NNCH3 (E)-1,2-Dimethyldiazene dmdiaze  
1014 C3H5OH Cyclopropanol cproh  
1015 C3H6O 2-Propen-1-ol c107186  
1016 C3H6O Acetone enol enol  
1017 C3H6O Propylene oxide prox  
1018 CH3CH2CHO Propanal propanal  
1019 CH3COCH3 Acetone acetone  
1020 CH3COCH3- acetone anion ch3coch3-  
1021 C3H6S Thietane thietane  
1022 C3H6S Thiirane, methyl- methiirane  
1023 CH3CSCH3 Thioacetone ch3csch3  
1024 C2H6O2 1,2-Ethanediol ethdiol  
1025 CH3OOCH3 dimethylperoxide dmp  
1026 CH3SOCH3 Dimethyl sulfoxide dmso  
1027 CH2SHCH2SH 1,2-Ethanedithiol ethdisl  
1028 CH3SSCH3 Disulfide, dimethyl ch3ssch3  
1029 CH3COHCH3+ acetone, protonated acetoneh+  
1030 HOCH2CH2NH2 monoethanolamine mea  
1031 C3H7OH 1-Propanol proh  
1032 CH3CHOHCH3 Isopropyl alcohol isoproh  
1033 CH3OC2H5 Ethane, methoxy- etome  
1034 C3H7SH 1-Propanethiol prsh  
1035 CH3CHSHCH3 2-Propanethiol isoprsh  
1036 CH3SCH2CH3 Ethane, (methylthio)- etsme  
1037 H2OCH3OCH3 water dimethylether dimer h2och3och3  
1038 Li2F2 Lithium fluoride dimer li2f2  
1039 Na2F2 Sodium Fluoride Dimer na2f2  
1040 Na2Cl2 Disodium dichloride na2cl2  
1041 C2F2 difluoroacetylene c2f2  
1042 C2Cl2 dichloroacetylene c2cl2  
1043 C2Cl2+ dichloroacetylene cation c2cl2+  
1044 FNO2 Nitryl fluoride fno2  
1045 FONO Nitrosyl hypofluorite fono  
1046 ClNO2 Nitryl chloride clno2  
1047 ClONO chlorine nitrite clono  
1048 BrONO Bromine nitrite brono  
1049 N2F2 (Z)-Difluorodiazene n2f2_z  
1050 N2F2 Dinitrogen difluoride, (E)- n2f2_e  
1051 CF2O Carbonic difluoride f2co  
1052 CF2O+ Carbonic difluoride cation f2co+  
1053 COFCl Carbonic chloride fluoride cofcl  
1054 CCl2O Phosgene cl2co  
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 AlF2Cl Aluminum chloride difluoride alclf2  
1061 ScF3 Scandium trifluoride ScF3  
1062 AlFCl2 Aluminum dichloride fluoride alcl2f  
1063 BCl3 Borane, trichloro- bcl3  
1064 BCl3+ Boron Trichloride cation bcl3+  
1065 GaF3 Gallium trifluoride gaf3  
1066 AlCl3 Aluminum trichloride alcl3  
1067 GaCl3 Gallium trichloride gacl3  
1068 BBr3 Boron tribromide bbr3  
1069 AlBr3 Aluminum Bromide albr3  
1070 ClO3 Chlorine trioxide clo3  
1071 ClO3- chlorate anion clo3-  
1072 BrO3- Bromate anion bro3-  
1073 CF3 Trifluoromethyl radical cf3  
1074 CF3- Trifluoromethyl anion cf3-  
1075 CF3+ Trifluoromethyl cation cf3+  
1076 CF2Cl difluorochloromethyl radical cf2cl  
1077 SiF3 Silicon trifluoride radical sif3  
1078 SiF3+ Silicon trifluoride cation sif3+  
1079 CFCl2 dichlorofluoromethyl radical cfcl2  
1080 CCl3 Trichloromethyl radical ccl3  
1081 CCl3- Trichloromethyl anion ccl3-  
1082 CCl3+ Trichloromethyl cation ccl3+  
1083 SiCl3 trichlorosilyl radical sicl3  
1084 SiCl3+ trichlorosilyl cation sicl3+  
1085 CBr3 tribromomethyl radical cbr3  
1086 FOOF Perfluoroperoxide foof  
1087 ClO2F Chloryl fluoride clo2f  
1088 F2SO Thionyl Fluoride f2so  
1089 ClOOCl Dichlorine dioxide cloocl  
1090 FSSF Difluorodisulfane fssf  
1091 S2F2 Thio-thionyl fluoride s2f2  
1092 SOCl2 thionyl chloride socl2  
1093 SSCl2 Thiothionyl chloride sscl2  
1094 SeOCl2 selenium oxychloride seocl2  
1095 NF3 Nitrogen trifluoride nf3  
1096 NF3- Nitrogen trifluoride anion nf3-  
1097 NF3+ Nitrogen trifluoride cation nf3+  
1098 PF3 Phosphorus trifluoride pf3  
1099 NCl3 nitrogen trichloride ncl3  
1100 AsF3 Arsenic trifluoride asf3  
1101 PCl3 Phosphorus trichloride pcl3  
1102 SbF3 Antimony Trifluoride sbf3  
1103 AsCl3 Arsenous trichloride ascl3  
1104 SbCl3 Antimony Trichloride sbcl3  
1105 NBr3 Nitrogen Tribromide nbr3  
1106 PBr3 Phosphorus tribromide pbr3  
1107 AsBr3 Arsenic tribromide asbr3  
1108 NI3 Nitrogen triiodide ni3  
1109 PI3 Phosphorus triiodide pi3  
1110 ClSSCl Disulfur dichloride s2cl2  
1111 SF3 Sulfur trifluoride sf3  
1112 ClF3 Chlorine trifluoride clf3  
1113 BrF3 Bromine trifluoride brf3  
1114 IF3 iodone trifluoride if3  
1115 HClO3 Chloric Acid hclo3  
1116 CHF3 Methane, trifluoro- chf3  
1117 CHF2Cl difluorochloromethane chf2cl  
1118 SiHF3 trifluorosilane sihf3  
1119 CHFCl2 fluorodichloromethane chfcl2  
1120 CDCl3 trichloromethane-d cdcl3  
1121 CHCl3 Chloroform chcl3  
1122 CHBrF2 Methane, bromodifluoro- chbrf2  
1123 SiHCl3 Trichlorosilane sihcl3  
1124 CHFClBr fluorochlorobromomethane chfclbr  
1125 CHBrCl2 Methane, bromodichloro- chbrcl2  
1126 CHF2I difluoroiodomethane chf2i  
1127 CHBr2F dibromofluoromethane chbr2f  
1128 CHFClI fluorochloroiodomethane chfcli  
1129 CHCl2I dichloroiodomethane chcl2i  
1130 CHClBr2 Methane, dibromochloro- chclbr2  
1131 CHBr3 bromoform chbr3  
1132 CHI3 Iodoform chi3  
1133 NF3H+ protonated nitrogen trifluoride nf3h+  
1134 AsF3H+ Arsenic trifluoride, protonated asf3h+  
1135 C2H2F2 Ethene, 1,2-difluoro-, (E)- c2h2f2e  
1136 C2H2F2 Ethene, 1,2-difluoro-, (Z)- c2h2f2z  
1137 CH2CF2 Ethene, 1,1-difluoro- ch2cf2  
1138 C2H2ClF 1-chloro-1-fluoroethylene c2h2clf  
1139 CHFCHCl (E)-1-chloro-2-fluoroethene chfchcle  
1140 CHFCHClz (Z)-1-Chloro-2-fluoroethene chfchclz  
1141 CH2CCl2 Ethene, 1,1-dichloro- ch2ccl2  
1142 CHClCHCl Ethene, 1,2-dichloro-, (E)- chclchcle  
1143 CHClCHCl Ethene, 1,2-dichloro-, (Z)- chclchclz  
1144 C2H2Br2 1,1-dibromoethene c2h2br2  
1145 CHBrCHBr Ethene, 1,2-dibromo-, (E)- chbrchbre  
1146 CHBrCHBr Ethene, 1,2-dibromo-, (Z)- chbrchbrz  
1147 CH2FCHO Fluoroacetaldehyde ch2fcho  
1148 CH3COF Acetyl fluoride ch3cof  
1149 CH2ClCHO chloroacetaldehyde ch2clcho  
1150 CH3COCl Acetyl Chloride ch3cocl  
1151 C2H4F2 1,2-difluoroethane c2h4f2  
1152 CH3CHF2 Ethane, 1,1-difluoro- ch3chf2  
1153 CH2FCH2Cl Ethane, 1-chloro-2-fluoro- ch2fch2cl  
1154 CH3CHFCl Ethane, 1-chloro-1-fluoro- ch3chfcl  
1155 CH2ClCH2Cl Ethane, 1,2-dichloro- ch2clch2cl  
1156 CH3CHCl2 Ethane, 1,1-dichloro- ch3chcl2  
1157 CH2BrCH2Cl 1-bromo-2-chloroethane ch2brch2cl  
1158 CH2BrCH2Br Ethane, 1,2-dibromo- ch2brch2br  
1159 CH2CFCH3 2-fluoropropene 2fpro  
1160 CH2CHCH2F Allyl Fluoride allylf  
1161 CH3CHCHF trans-1-Fluoro-1-propene propene1ft  
1162 C3H5Cl 1-Propene, 3-chloro- prop1cl3  
1163 C3H5Cl 1-chloro-1-propene(E) prop1cl1e  
1164 C3H5Cl 1-chloro-1-propene(Z) prop1cl1z  
1165 CH2FCH2OH 2-fluoroethanol ch2fch2oh  
1166 CH2ClCH2OH 2-Chloroethanol ch2clch2oh  
1167 CH2ClCH2OH2+ 2-chloroethanol, protonated ch2clch2oh2+  
1168 CH2FCH2CH3 1-Fluoropropane prf1  
1169 CH3CHFCH3 2-Fluoropropane prf2  
1170 CH2ClCH2CH3 Propane, 1-chloro- prcl1  
1171 CH3CHClCH3 Propane, 2-chloro- prcl2  
1172 CH3CH2CH2Br n-propyl bromide prbr  
1173 CH3CHBrCH3 i-propyl bromide iprbr  
1174 C3H9O+ trimethyl oxonium cation c3h9o+  
1175 B5H9 pentaborane9 b5h9  
1176 C5H4 pentatetraene ptrene  
1177 C5H5 cyclopentadienyl radical c5h5  
1178 C5H5- cylopentadienyl anion c5h5-  
1179 C5H6 1,3-Cyclopentadiene c542927  
1180 C5H6 1-Buten-3-yne, 2-methyl- c78808  
1181 C5H6 3-Penten-1-yne, (E)- c2004695  
1182 C5H6 3-Penten-1-yne, (Z)- c1574409  
1183 C5H6 Bicyclo[2.1.0]pent-2-ene c5164352  
1184 C5H6 Cyclopropylacetylene c6746947  
1185 C5H6 Propellane propellane  
1186 C5H7 1,3-pentadienyl radical pdyl  
1187 C5H7 cyclopentenyl radical cpyl  
1188 C5H8 1,2-Butadiene, 3-methyl- c598254  
1189 C5H8 1,2-Pentadiene c591957  
1190 C5H8 1,3-Butadiene, 2-methyl- c78795  
1191 C5H8 1,3-Pentadiene, (E)- c2004708  
1192 C5H8 1,3-Pentadiene, (Z)- c1574410  
1193 C5H8 1,4-Pentadiene c591935  
1194 C5H8 1-pentyne a1pentyne  
1195 C5H8 2,3-Pentadiene c591968  
1196 C5H8 Bicyclo[1.1.1]pentane bcp  
1197 C5H8 Cyclobutane, methylene- c1120565  
1198 C5H8 Cyclopentene c142290  
1199 C5H8 Ethenylcyclopropane c693867  
1200 CH3CCCH2CH3 2-Pentyne 2pentyne  
1201 C5H10 1-Butene, 2-methyl- c563462  
1202 C5H10 2-Butene, 2-methyl- c513359  
1203 C5H10 2-Pentene, (E)- c646048  
1204 C5H10 2-Pentene, (Z)- c627203  
1205 C5H10 Cyclopentane c287923  
1206 C5H10 Cyclopropane, 1,1-dimethyl- c1630940  
1207 CH2CHCH2CH2CH3 1-pentene pentene  
1208 C5H11 2-Methylbut-2-yl radical c4348350  
1209 C5H12 Butane, 2-methyl- buta2  
1210 C5H12 Pentane pentane  
1211 C5H12 Propane, 2,2-dimethyl- neopentane  
1212 Si(CH3)4 tetramethylsilane tms  
1213 N2O3 Dinitrogen trioxide n2o3  
1214 C3H2N2 Malononitrile c3h2n2  
1215 CH2N4 1H-Tetrazole 1htz  
1216 C3H3N2 imidazolyl radical im  
1217 C3H3N2- imidizolyl anion im-  
1218 C2H3N3 1H-1,2,4-Triazole c288880  
1219 C4H4N pyrrolide radical c4h4n  
1220 C4H4N- pyrrolide anion c4h4n-  
1221 C3H4N2 1H-Imidazole 1himidaz  
1222 C3H4N2 1H-Pyrazole 1hpyraz  
1223 C3H4N2 2H-Imidazole imid2h  
1224 C3H4N2 4H-Imidazole imid4h  
1225 C4H5N (E)-2-Butenenitrile c627269  
1226 C4H5N (Z)-2-Butenenitrile c1190767  
1227 C4H5N 2H-pyrrole pyrrole2  
1228 C4H5N 3H-pyrrole pyrrole3  
1229 C4H5N Cyclopropanecarbonitrile c5500210  
1230 C4H5N Pyrrole pyrrole  
1231 CH2CHCH2CN Allylcyanide ch2chch2cn  
1232 C4H6N+ pyrrole, alpha-protonated appyr  
1233 C4H6N+ pyrrole, beta-protonated bppyr  
1234 C4H6N+ pyrrole, protonated ppyr  
1235 C3H6N2 3-Aminopropionitrile c151188  
1236 CH3CH(CH3)CN Propanenitrile, 2-methyl- c4h7n  
1237 CH3CH2CH2CN Butanenitrile c109740  
1238 C5H8 Bicyclo[2.1.0]pentane c185944  
1239 C5H8 Spiropentane c157404  
1240 C4H9N Cyclobutylamine cbam  
1241 C4H9N Pyrrolidine pyrrolidine  
1242 C3H10N2 1,2-Diaminopropane diampr12  
1243 C(CH3)3NH2 2-Propanamine, 2-methyl- c75649  
1244 C(NH2)H2C(CH3)HCH3 1-Propanamine, 2-methyl- c78819  
1245 C(NH2)H2CH2CH2CH3 1-Butanamine butam1  
1246 CH3C(NH2)HCH2CH3 2-Butanamine butam2  
1247 NH(C2H5)2 diethylamine dea  
1248 NC4H12+ tetramethyl ammonium cation nc4h12+  
1249 C3O2 Carbon suboxide c3o2  
1250 C3O2+ Carbon suboxide cation c3o2+  
1251 B2O3 diboron trioxide b2o3  
1252 MgCO3 Magnesium Carbonate mgco3  
1253 BeCO3 Beryllium Carbonate beco3  
1254 CaCO3 Calcium Carbonate caco3  
1255 ONONO Nitrosyl nitrite onono  
1256 PO4--- phosphate po4---  
1257 SO4-- sulfate so4--  
1258 HOONO2 peroxy nitric acid hoono2  
1259 HSO4- bisulfate anion hso4-  
1260 C2H2N2S 1,3,4-Thiadiazole c2h2n2s  
1261 C3H2O2 Propiolic acid c3h2o2  
1262 CHOCOOH oxo acetic acid oaa  
1263 CHOOCHO diformyl ether choocho  
1264 H2SO4 Sulfuric acid h2so4  
1265 H2SeO4 Selenic acid h2seo4  
1266 C3H3NO Isoxazole isox  
1267 C3H3NO Oxazole oxazole  
1268 C3H3NS Thiazole thiazole  
1269 CH3C(O)OO acetyl peroxy radical ch3coo2  
1270 CH3NO3 Methyl nitrate ch3no3  
1271 H3PO4 Phosphoric Acid h3po4  
1272 C4H4O Furan furan  
1273 C4H4O+ Furan cation furan+  
1274 CH3COCCH 3-butyn-2-one c1423605  
1275 C4H4S Thiophene furans  
1276 C4H4Se selenophene c4h4se  
1277 C3H4O2 β–Propiolactone beta  
1278 C3H4O2 2-Propenoic acid propenoic2  
1279 C3H4O2 Methyl glyoxal megly  
1280 C3H4O2 propanedial propanedial  
1281 C3H4O2 propenalol propenalol  
1282 HOCHCCHOH allenediol aldiol  
1283 C2H4O3 1,2,3-trioxolane c2h4o3  
1284 C2H4O3 trioxolane124 triox  
1285 HOCH2COOH Hydroxyacetic acid hac  
1286 CH2CHCONH2 Acrylamide c79061  
1287 CH3OCH2CN Methoxyacetonitrile c1738369  
1288 CH5N3S Hydrazinecarbothioamide c79196  
1289 H2NCH2COOH Glycine glycine  
1290 CH3SO2NH2 methanesulfonamide ch3so2nh2  
1291 C4H6O cis-2-butenal butenal2c  
1292 C4H6O Cyclobutanone cbutone  
1293 C4H6O Furan, 2,3-dihydro- furan23h  
1294 C4H6O Furan, 2,5-dihydro- furan25h  
1295 CH2CHOCHCH2 Vinyl ether vinylether  
1296 CHOCHCHCH3 2-Butenal butenal2  
1297 C4H6S Thiophene, 2,3-dihydro- thiop23h  
1298 C4H6S Thiophene, 2,5-dihydro- thiop25h  
1299 CH2CHSCHCH2 Divinyl sulfide divis  
1300 C2H6N2O Urea, methyl- c598505  
1301 C3H6O2 1,3-Dioxolane dioxolane  
1302 CH3CH2COOH Propanoic Acid propanoic  
1303 CH3COOCH3 methyl acetate aame  
1304 HCOOC2H5 Ethyl formate faee  
1305 C2H6O2S Dimethyl sulfone c67710  
1306 CH3SSSCH3 dimethyl trisulfide c2h6s3  
1307 C3H7NO dimethylformamide dmf  
1308 C3H7NO Propanamide propanam  
1309 C2H3OC2H5 Ethene, ethoxy- c109922  
1310 C4H8O Cyclobutanol c2919235  
1311 C4H8O Furan, tetrahydro- thf  
1312 CH2C(CH3)OCH3 1-Propene, 2-methoxy- pre1meo2  
1313 CH3COCH2CH3 2-Butanone buta2one  
1314 CHOCH(CH3)CH3 Propanal, 2-methyl- c78842  
1315 CHOCH2CH2CH3 Butanal butanal  
1316 C4H8S Thiophene, tetrahydro- tht  
1317 C3H8O2 1,3-Propanediol c504632  
1318 C3H8O2 Hydroperoxide, 1-methylethyl c3031752  
1319 C3H8O2 Methane, dimethoxy- c109875  
1320 C3H8O2 Propylene glycol c57556  
1321 C3H8S2 1,3-Propanedithiol c109808  
1322 C4H10O 1-Butanol butanol1  
1323 C4H10O 1-Propanol, 2-methyl- c78831  
1324 C4H10O 2-Butanol, (.+/-.)- butanol2  
1325 C4H10O Ethanol, 1,1-dimethyl- tbuoh  
1326 C4H10O Ethoxy ethane etoet  
1327 C4H10O Methyl propyl ether meopr  
1328 C4H10O Propane, 2-methoxy- c598538  
1329 C4H10O+ 1-Butanol cation butanol1+  
1330 C(CH3)3SH 2-Propanethiol, 2-methyl- tbush  
1331 C2H5SC2H5 Diethyl sulfide etset  
1332 C4H9SH 1-Butanethiol bush  
1333 CH2(SH)CH(CH3)CH3 1-Propanethiol, 2-methyl- c513440  
1334 CH3C(SCH3)HCH3 Propane, 2-(methylthio)- mesipr  
1335 CH3CH(SH)CH2CH3 2-Butanethiol butansl2  
1336 FNO3 Fluorine nitrate fno3  
1337 ClONO2 Chlorine nitrate clono2  
1338 BrONO2 Bromine nitrate brono2  
1339 TiCl4 Titanium tetrachloride ticl4  
1340 ClO4- perchlorate anion clo4-  
1341 BF4- tetrafluoroboron anion bf4-  
1342 ClFO3 Perchloryl fluoride clfo3  
1343 SO2F2 Sulfuryl fluoride so2f2  
1344 SO2Cl2 Sulfuryl chloride so2cl2  
1345 F3NO Nitrogen trifluoride oxide f3no  
1346 F3PO Phosphoryl fluoride pf3o  
1347 Cl3PO Phosphoryl chloride pcl3o  
1348 CF4 Carbon tetrafluoride cf4  
1349 CF3Cl Methane, chlorotrifluoro- cf3cl  
1350 SiF4 Silicon tetrafluoride sif4  
1351 CF2Cl2 difluorodichloromethane cf2cl2  
1352 TiF4 Titanium tetrafluoride tif4  
1353 CFCl3 Trichloromonofluoromethane cfcl3  
1354 CF3Br Bromotrifluoromethane cf3br  
1355 GeF4 Germanium tetrafluoride gef4  
1356 CCl4 Carbon tetrachloride ccl4  
1357 CCl4+ Carbon tetrachloride cation ccl4+  
1358 CBrClF2 Methane, bromochlorodifluoro- cbrclf2  
1359 SiCl4 Silane, tetrachloro- sicl4  
1360 CBrCl2F bromodichlorofluoromethane cbrcl2f  
1361 CF3I trifluoroiodomethane cf3i  
1362 CBrCl3 Methane, bromotrichloro- cbrcl3  
1363 CBr2F2 Methane, dibromodifluoro- cbr2f2  
1364 GeCl4 Germanium Tetrachloride gecl4  
1365 CBr2ClF dibromochlorofluoromethane cbr2clf  
1366 CBr2Cl2 dibromodichloromethane cbr2cl2  
1367 CCl3I trichloroiodomethane ccl3i  
1368 CFBr3 fluorotribromomethane cfbr3  
1369 CFClBrI fluorochlorobromoiodomethane cfclbri  
1370 CBr3Cl tribromochloromethane cbr3cl  
1371 CF2I2 difluorodiiodomethane cf2i2  
1372 CBr4 Carbon tetrabromide cbr4  
1373 CCl2I2 dichlorodiiodomethane ccl2i2  
1374 SiBr4 Silicon tetrabromide sibr4  
1375 CBr3I tribromoiododmethane cbr3i  
1376 GeBr4 Germanium tetrabromide gebr4  
1377 CI4 tetraiodomethane ci4  
1378 SiI4 silicon tetraiodide sii4  
1379 ClOF3 Chlorine trifluoride oxide clof3  
1380 SF4 Sulfur tetrafluoride sf4  
1381 SeF4 Selenium tetrafluoride sef4  
1382 SCl4 Sulfur tetrachloride scl4  
1383 C2HF3 Trifluoroethylene c2hf3  
1384 C2HF3+ Trifluoroethylene cation c2hf3+  
1385 CHClCCl2 Trichloroethylene chclccl2  
1386 CHBrCF2 1-Bromo-2,2-difluoroethylene chbrcf2  
1387 HClO4 perchloric acid hclo4  
1388 HSO3F Fluorosulfonic acid hso3f  
1389 CF3OH trifluoromethanol cf3oh  
1390 CH2ClCCCl 1,3-dichloropropyne ch2clcccl  
1391 CHClCCHCl 1,3-dichloroallene chclcchcl  
1392 CHCl2CCH 3,3-dichloropropyne chcl2cch  
1393 CHCl2CHO dichloroacetaldehyde chcl2cho  
1394 PF3CH2 phosphorane, trifluoromethylene- pf3ch2  
1395 CH3CF3 Ethane, 1,1,1-trifluoro- ch3cf3  
1396 CHF2CH2F Ethane, 1,1,2-trifluoro ch2fchf2  
1397 CH3CF2Cl 1-Chloro-1,1-Difluoroethane ch3cf2cl  
1398 CH3CFCl2 1,1-Dichloro-1-fluoroethane ch3cfcl2  
1399 CH2ClCHCl2 1,1,2-trichloroethane ch2clchcl2  
1400 CH3CCl3 Ethane, 1,1,1-trichloro- ch3ccl3  
1401 SiCl3CH3 methyltrichlorosilane sicl3ch3  
1402 CH3CBr3 1,1,1-tribromoethane ch3cbr3  
1403 NH3BCl3 Amminetrichloroboron nh3bcl3  
1404 SiH3CCl3 (trichloromethyl)silane sih3ccl3  
1405 CH2CClCHCH2 1,3-Butadiene, 2-chloro- c4h5cl  
1406 C3H5ClO Oxirane, (chloromethyl)- c106898  
1407 CH2FCH2CH2F 1,3-difluoropropane ch2fch2ch2f  
1408 CH3CF2CH3 2,2-difluoropropane ch3cf2ch3  
1409 CH2ClCH2CH2Cl 1,3-dichloropropane prdicl13  
1410 CH2ClCHClCH3 Propane, 1,2-dichloro- prdicl12  
1411 CH3CCl2CH3 Propane, 2,2-dichloro- prdicl22  
1412 CHCl2CH2CH3 1,1-dichloropropane prdicl11  
1413 SiCl2(CH3)2 dichlorodimethylsilane sicl2me2  
1414 CH2CClCH2CH3 1-Butene, 2-chloro- bute1cl2  
1415 CH2CHCH2CH2Cl 1-Butene, 4-chloro- bute1cl4  
1416 CH2CHCHClCH3 1-Butene, 3-chloro- bute1cl3  
1417 CH2ClCHCHCH3 2-Butene, 1-chloro- bute2cl1  
1418 CH3CClCHCH3 2-Butene, 2-chloro-, (E)- bute2cl2e  
1419 CH3CClCHCH3 2-Butene, 2-chloro-, (Z)- bute2cl2z  
1420 CHClCHCH2CH3 (E)-1-Chloro-1-butene bute1cl1  
1421 CHClCHCH2CH3 (Z)-1-Chloro-1-butene bute1cl1z  
1422 C4H9F 1-fluorobutane butaf1  
1423 CH3CHFCH2CH3 2-fluorobutane butaf2  
1424 CH2ClCH2CH2CH3 Butane, 1-chloro- butacl1  
1425 CH3CCl(CH3)CH3 Propane, 2-chloro-2-methyl- procl2me2  
1426 CH3CHClCH2CH3 Butane, 2-chloro- butacl2  
1427 XeF4 Xenon tetrafluoride xef4  
1428 C2H2N2O Furazan furazan  
1429 CF3PH2 phosphine, (trifluoromethyl)- cf3ph2  
1430 NH3BF3 Amminetrifluoroboron nh3bf3  
1431 C6H2 hexatriyne c6h2  
1432 C6H4 (E)-Hexa-1,5-diyne-3-ene c6h4e  
1433 C6H4 (Z)-Hexa-1,5-diyne-3-ene c6h4z  
1434 C6H4 Benzyne benzyne  
1435 C6H5 phenyl phenyl  
1436 C6H5- phenyl anion phenyl-  
1437 C6H6 Prismane prismane  
1438 C6H6 1,2,4,5-Hexatetraene ht1245  
1439 C6H6 2,4-Hexadiyne hexadiyne  
1440 C6H6 3,4-Dimethylenecyclobutene cb34m  
1441 C6H6 Benzene benzene  
1442 C6H6 Benzvalene bv  
1443 C6H6 Dewar Benzene dewar  
1444 C6H6 Hexa-1,5-diene-3-yne hdy153  
1445 C6H6 Trimethylenecycopropane tmcp  
1446 C6H6+ Benzene cation c6h6+  
1447 C6H7+ benzene, protonated c6h7+  
1448 C6H8 (E)-hexa-1,3,5-triene c821078  
1449 C6H8 (E)-hexa-2,3,4-triene c59660650  
1450 C6H8 (Z)-hexa-1,3,5-triene hexatri135  
1451 C6H8 (Z)-hexa-2,3,4-triene hetr234c  
1452 C6H8 1,3-Cyclohexadiene cyhexadiene13  
1453 C6H8 1,4-Cyclohexadiene cyhexadiene14  
1454 C6H8 3-Methylenecyclopentene c930267  
1455 C6H8 Bicyclo[2.1.1]hex-2-ene c822413  
1456 C6H8 Bicyclo[2.2.0]hex-1(4)-ene c30830207  
1457 C6H8 Bicyclo[3.1.0]hex-2-ene c694019  
1458 C6H10 1,3-Hexadiene, (E)- hexdi13e  
1459 C6H10 1,3-Hexadiene, (Z)- hexdi13z  
1460 C6H10 1,4-Hexadiene, (E)- hexdi14t  
1461 C6H10 1,4-Hexadiene, (Z)- hexdi14z  
1462 C6H10 1,5-Hexadiene c592427  
1463 C6H10 1-Butyne, 3,3-dimethyl- c917920  
1464 C6H10 1-Hexyne hexyne1  
1465 C6H10 2,4-Hexadiene, (E,E)- hexdi24ee  
1466 C6H10 2,4-Hexadiene, (E,Z)- hexdi24ez  
1467 C6H10 2,4-Hexadiene, (Z,Z)- hexdi24zz  
1468 C6H10 2-Hexyne c764352  
1469 C6H10 3-Hexyne hexyne3  
1470 C6H10 cyclohexene cyclohexene  
1471 C6H10 Cyclopentene, 1-methyl- c693890  
1472 C6H10 Cyclopentene, 3-methyl- c1120623  
1473 C6H10 Cyclopentene, 4-methyl- c1759815  
1474 C4H6(CH3)2 1,1-dimethylcyclobutane dmcb11  
1475 C6H12 (1R,2R)-1,2-dimethylcyclobutane dmcb12t  
1476 C6H12 (1r,3r)-1,3-dimethylcyclobutane dmcb13t  
1477 C6H12 (E)-2-Hexene e2hexene  
1478 C6H12 (E)-3-methylpent-2-ene c616126  
1479 C6H12 (E)-hex-3-ene e3hexene  
1480 C6H12 (Z)-3-methylpent-2-ene c922623  
1481 C6H12 (Z)-hex-2-ene z2hexene  
1482 C6H12 (Z)-hex-3-ene z3hexene  
1483 C6H12 2,3-dimethylbut-1-ene c563780  
1484 C6H12 2,3-dimethyl-but-2-ene tmeet  
1485 C6H12 3-methylenepentane c760214  
1486 C6H12 cis-1,2-dimethylcyclobutane dmcb12c  
1487 C6H12 cis-1,3-dimethylcyclobutane dmcb13c  
1488 C6H12 Cyclohexane cyclohexane  
1489 C6H12 Cyclopentane, methyl- c96377  
1490 C6H12 Ethylcyclobutane c4806615  
1491 C6H12 hex-1-ene hexene1  
1492 C6H14 Butane, 2,2-dimethyl- buta22  
1493 C6H14 Butane, 2,3-dimethyl- buta23  
1494 C6H14 Hexane hexane  
1495 C6H14 Pentane, 2-methyl- penta2  
1496 C6H14 Pentane, 3-methyl- penta3  
1497 C4N2 2-Butynedinitrile c4n2  
1498 N3P3 1,3,5,2,4,6-Triazatriphosphorine n3p3  
1499 C4H2N2 Fumaronitrile c4h2n2  
1500 C2H2N4 sym-tetrazine ttz  
1501 C3H3N3 1,3,5-Triazine triazine135  
1502 CH3N5 5-Aminotetrazole c4418615  
1503 C4H4N2 1,3-Diazine diazine13  
1504 C4H4N2 Pyrazine pyrazine  
1505 C4H4N2 Pyridazine pyridazine  
1506 C4H4N2 Succinonitrile c110612  
1507 C2H4N4 1H-Tetrazole, 1-methyl- c16681779  
1508 C2H4N4 1H-Tetrazole, 5-methyl- c4076362  
1509 C2H4N4 2H-Tetrazole, 2-methyl- c16681780  
1510 C5H5N Bicyclo[1.1.0]butane-1-carbonitrile bibucn  
1511 C5H5N E-2,4-pentadienenitrile bdcn  
1512 C5H5N Pyridine pyridine  
1513 B3N3H6 borazine borazine  
1514 C6H6 Fulvene fulvene  
1515 C5H6N+ Pyridinium c5h6n  
1516 C4H6N2 1H-Imidazole, 2-methyl- c693981  
1517 C5H7N (E)-2-Pentenenitrile c26294984  
1518 C5H7N (E)-3-Pentenenitrile c16529661  
1519 C5H7N (Z)-2-Pentenenitrile c25899507  
1520 C5H7N 1H-Pyrrole, 1-methyl- c96548  
1521 C5H7N Cyclobutanecarbonitrile c4426113  
1522 C5H9N 1,2,3,6-Tetrahydropyridine c694053  
1523 C5H9N Butanenitrile, 2-methyl- c18936179  
1524 C5H9N Pentanenitrile c110598  
1525 C5H9N Propanenitrile, 2,2-dimethyl- c630182  
1526 C6H10 Bicyclo[3.1.0]hexane c285585  
1527 C5H11N Cyclopentanamine cypentam  
1528 C5H11N Piperidine piper  
1529 C4H12N2 1,2-Butanediamine c4426486  
1530 C4H12N2 2-Methyl-1,2-propanediamine c811938  
1531 Li2CO3 Lithium Carbonate li2co3  
1532 Na2CO3 Sodium Carbonate na2co3  
1533 C2O4-- oxalate anion c2o4  
1534 MgSO4 Magnesium Sulfate mgso4  
1535 N2O4 Dinitrogen tetroxide n2o4  
1536 C3H2O3 vinylene carbonate vica  
1537 C2H2O4 Oxalic Acid oxalic  
1538 C2H3NO3 Oxamic acid oxamic  
1539 C4H4O2 2(5H)-Furanone furanone  
1540 C4H4O2 2-Oxetanone, 4-methylene- c674828  
1541 C2H4N2O2 Oxalamide oxalamide  
1542 C2H4N2S2 Ethanedithioamide c79403  
1543 C2H4CO3 Ethylene carbonate etco3  
1544 C3H4O2S 2H-Thiete-1,1-dioxide c7285327  
1545 C3H4S3 1,3-Dithiolane-2-thione c822388  
1546 C2H4O4 Formic acid dimer fadimer  
1547 C4H5NO 3-Methylisoxazole isox3m  
1548 C4H5NO Isoxazole, 5-methyl- c5765446  
1549 C4H5NS 4-Methylthiazole c693958  
1550 C2H5NO3 Nitric acid, ethyl ester c625581  
1551 C5H6O 2H-Pyran pyran2  
1552 C5H6O 2-methylfuran furan2m  
1553 C5H6O 3-Methylfuran furan3m  
1554 C5H6O Pentadienal pdal  
1555 C5H6S Thiophene, 2-methyl- c554143  
1556 C5H6S Thiophene, 3-methyl- c616444  
1557 C4H6O2 γ–Butyrolactone c96480  
1558 C4H6O2 2,3-Butanedione c431038  
1559 C4H6O2 2-Propenoic acid, methyl ester c96333  
1560 C4H6O2 Crotonic Acid crot  
1561 C4H6OS 2,3-dihydrothiophene-2-ol c9000117  
1562 C4H6OS 2,5-dihydrothiophene-3-ol c9000093  
1563 C4H6OS 4,5-dihydrothiophene-2-ol c9000106  
1564 C4H6OS 4,5-dihydrothiophene-3-ol c9000082  
1565 C4H6OS Dihydro-2-(3H)-thiophenone c1003107  
1566 C4H6OS Dihydro-3-(2H)-thiophenone c1003049  
1567 C4H6OS Vinyl sulfoxide c1115157  
1568 CH6N4S Carbonothioic dihydrazide thiacarb  
1569 C2H6N2O2 (E)-Azodioxymethane c37765154  
1570 C2H6N2O2 Dimethylnitroamine c4164287  
1571 C3H6O3 1,3,5-Trioxane trioxane  
1572 C3H6S3 1,3,5-Trithiane c3h6s3  
1573 C3H6S3 Carbonotrithioic acid, dimethyl ester c2314489  
1574 C2H6O3S Sulfurous acid, dimethyl ester c616422  
1575 C4H7NO 2-Pyrrolidinone c616455  
1576 C4H7NO Ethoxyacetonitrile etoaccn  
1577 C4H7NO Methacrylamide c79390  
1578 C4H7NO Oxazole, 4,5-dihydro-2-methyl- c1120645  
1579 HCONH2CN2H4 formamide aminomethanimine dimer d13  
1580 C3H7ONO Propyl nitrite prono  
1581 CH3CH(CH3)ONO Isopropyl nitrite c541424  
1582 CH3CH(NH2)COOH Alanine alanine  
1583 CH3NHCH2COOH Sarcosine sarcosine  
1584 NH2CH2CH2COOH β–alanine betaalanine  
1585 NH2COOC2H5 Urethane urethane  
1586 C5H8O 2H-Pyran, 3,4-dihydro- c110872  
1587 C5H8O Cyclopentanone c120923  
1588 C5H8O Furan, 2,3-dihydro-5-methyl- c1487156  
1589 C5H8O Methyl cyclopropyl ketone c765435  
1590 N(CH3)2CONH2 Urea, N,N-dimethyl- c598947  
1591 NH(CH3)CONH(CH3) Urea, N,N'-dimethyl- c96311  
1592 NH2CONHC2H5 Urea, ethyl- c625525  
1593 C4H8O2 1,3-Dioxane dioxan13  
1594 C4H8O2 1,3-Dioxolane, 2-methyl- c497267  
1595 C4H8O2 1,4-Dioxane dioxan14  
1596 C4H8O2 Ethene, 1,1-dimethoxy- c922690  
1597 C4H8O2 Ethyl acetate c141786  
1598 C4H8OS s-Ethyl thioacetate c625605  
1599 C3H8O3 1,2,3-Propanetriol glycerin  
1600 C3H8O2S (Methylsulfonyl)ethane c594434  
1601 C4H9NO Butanamide c541355  
1602 C4H9NO Propanamide, 2-methyl- c563837  
1603 C5H10O 2-Butanone, 3-methyl- c563804  
1604 C5H10O 2H-Pyran, tetrahydro- c142687  
1605 C5H10O 2-methylbutyraldehyde 2meba  
1606 C5H10O 2-Pentanone mpk  
1607 C5H10O 3-Pentanone dek  
1608 C5H10O Cyclopentanol c96413  
1609 C5H10O Oxetane, 3,3-dimethyl- c6921353  
1610 C5H10O Pentanal pal  
1611 C5H10S 2H-Thiopyran, tetrahydro- c1613510  
1612 C5H10S 3-Ethylthio-1-propene c5296628  
1613 C5H10S Cyclopentanethiol c1679078  
1614 C5H10S Thiophene, tetrahydro-2-methyl- c1795091  
1615 C5H10S Thiophene, tetrahydro-3-methyl- c4740005  
1616 C4H10O2 1,1-Dimethoxyethane c534156  
1617 C4H10O2 1,3-Butanediol budiol13  
1618 C4H10O2 1,4-Butanediol budiol14  
1619 C4H10O2 Ethane, 1,2-dimethoxy- c110714  
1620 C4H10OS Diethyl sulfoxide c70291  
1621 C4H10S2 1,4-Butanedithiol budisl14  
1622 C4H11NO Diethylhydroxylamine c3710847  
1623 C5H12O 1-Butanol, 2-methyl- c137326  
1624 C5H12O 1-Butanol, 3-methyl- c123513  
1625 C5H12O 1-Pentanol pentanol1  
1626 C5H12O 2-Butanol, 3-methyl- c598754  
1627 C5H12O 2-Pentanol peol2  
1628 C5H12O 3-Pentanol pentan3ol  
1629 C5H12O Butane, 1-methoxy- meobu  
1630 C5H12O Propane, 1-ethoxy- proet  
1631 C5H12O Propane, 2-methoxy-2-methyl- c1634044  
1632 C5H12S 1-Butanethiol, 2-methyl- c1878188  
1633 C5H12S 1-Butanethiol, 3-methyl- c541311  
1634 C5H12S 1-Pentanethiol c110667  
1635 C5H12S 1-Propanethiol, 2,2-dimethyl- c1679089  
1636 C5H12S 2-Butanethiol, 2-methyl- c1679090  
1637 C5H12S 2-Butanethiol, 3-methyl- c2084186  
1638 C5H12S Butane, 1-(methylthio)- c628295  
1639 C5H12S Ethyl propyl sulfide c4110503  
1640 C5H12S Propane, 2-(ethylthio)- c5145993  
1641 C5H12S Propane, 2-methyl-2-(methylthio)- c6163640  
1642 C4F2 difluorobutadiyne c4f2  
1643 ClCOClCO Oxalyl chloride oxcl  
1644 CF3CN Acetonitrile, trifluoro- cf3cn  
1645 CF3CN+ Acetonitrile, trifluoro- cation cf3cn+  
1646 B2F4 Diboron tetrafluoride b2f4  
1647 B2Cl4 Diboron tetrachloride b2cl4  
1648 C2F4 Tetrafluoroethylene c2f4  
1649 C2F4+ Tetrafluoroethylene cation c2f4+  
1650 C2ClF3 Ethene, chlorotrifluoro- c2f3cl  
1651 CF2CCl2 difluorodichloroethylene cf2ccl2  
1652 CFClCClF trans-1,2-dichloro-1,2-difluoroethylene cfclcclf  
1653 CFClCFCl cis-1,2-dichloro-1,2-difluoroethylene cfclcfcl  
1654 C2FCl3 fluorotrichloroethene c2fcl3  
1655 C2Cl4 Tetrachloroethylene c2cl4  
1656 C2Br4 tetrabromoethene c2br4  
1657 CF3OF Trifluoromethylhypofluorite cf3of  
1658 SiF5- silicon pentafluoride anion sif5-  
1659 SOF4 Sulfur tetrafluoride oxide sof4  
1660 PF5 Phosphorus pentafluoride pf5  
1661 AsF5 Arsenic pentafluoride asf5  
1662 PCl5 Phosphorus pentachloride pcl5  
1663 SF5 Sulfur pentafluoride sf5  
1664 SF5+ pentafluoro sulfur cation sf5+  
1665 SbCl5 Antimony pentachloride sbcl5  
1666 BrF5 bromine pentafluoride brf5  
1667 ClF5 chlorinepentafluoride clf5  
1668 IF5 pentafluoroiodine if5  
1669 CF3CHO trifluoroacetaldehyde cf3cho  
1670 CCl3CHO trichloroacetaldehyde ccl3cho  
1671 CHFClCHClF ethane, 1,2-dichloro-1,2-difluoro- chfclchclf  
1672 CF3CH2F 1,1,1,2-tetrafluoroethane cf3ch2f  
1673 CHF2CHF2 1,1,2,2-tetrafluoroethane chf2chf2  
1674 CF3CH2Cl 2,2,2-Trifluoroethyl chloride cf3ch2cl  
1675 CHFClCHFCl 1,2-dichloro-1,2-difluoroethane RR chfclchfcl  
1676 CH2ClCCl3 1,1,1,2-tetrachloroethane ch2clccl3  
1677 CHCl2CHCl2 Ethane, 1,1,2,2-tetrachloro- chcl2chcl2  
1678 CH2BrCBr3 1,1,1,2-tetrabromo ethane c2h2br4  
1679 CHCl2CHF2 1,1-dichloro-2,2-difluoroethane c2h2cl2f2  
1680 CF3COOH trifluoroacetic acid cf3cooh  
1681 C4H3ClO Furan, 2-chloro fur2cl  
1682 C4H3ClO Furan,3-chloro fur3cl  
1683 C3H5ClO2 Carbonochloridic acid, ethyl ester c541413  
1684 C3H5Cl3 Propane, 1,2,3-trichloro- prcl135  
1685 C4H8Cl2 1,4-Dichlorobutane c110565  
1686 C4H8Cl2 Butane, 1,2-dichloro- c616217  
1687 C4H8Cl2 Butane, 1,3-dichloro- c1190223  
1688 C4H8Cl2 Butane, 2,3-dichloro-, (r*,r*)-(.+/-.)- c2211678  
1689 C4H8Cl2 Butane, 2,3-dichloro-, (r*,s*)- c4028562  
1690 C4H9ClO 1-Chloro-2-ethoxyethane c628342  
1691 C5H11Cl Pentane, 1-chloro- pencl1  
1692 C4H8O2 Butanoic acid bua  
1693 C6H5CH2 benzyl radical benzyl  
1694 C7H7 cycloheptatrienyl radical c7h7  
1695 C7H7+ cycloheptatrienyl cation c7h7+  
1696 C6H5CH3 toluene toluene  
1697 C7H8 cycloheptatriene cht  
1698 C7H8 Norbornadiene norbor  
1699 C7H8 Quadricyclane qucy  
1700 C7H12 Norbornane nor  
1701 C7H14 cycloheptane c7h14  
1702 C7H16 2-methylhexane 2mhex  
1703 C7H16 3-methylhexane hex3m  
1704 C7H16 heptane heptane  
1705 CH(CN)3 tricyanomethane mecn3  
1706 HN=C=C(CN)2 Dicyanoketenimine c4hn3  
1707 C6H7N 2-Methylpyridine mp  
1708 C6H5NH2 aniline aniline  
1709 C6H13N 2-Methylpiperidine pip2m  
1710 C6H13N cyclohexanamine cham  
1711 C6H15N triethylamine tea  
1712 N2O5 Dinitrogen pentoxide n2o5  
1713 C4H2O3 Maleic Anhydride malan  
1714 C5H4O2 4-Cyclopentene-1,3-dione cpdio  
1715 C5H4O2 furfural furfural  
1716 C6H5O phenoxy radical phenoxy  
1717 C5H5NO 2(1H)-Pyridinone c72762006  
1718 C5H5NO 2(3H)-Pyridinone c9000048  
1719 C5H5NO 2(5H)-Pyridinone c9000037  
1720 C5H5NO 2-Pyridinol c109104  
1721 C5H5NO 3(2H)-Pyridinone c9000004  
1722 C5H5NO 3(4H)-Pyridinone c9000026  
1723 C5H5NO 3(6H)-Pyridinone c9000015  
1724 C5H5NO 3-Pyridinol c109002  
1725 C5H5NO 4(1H)-Pryidinone c9000060  
1726 C5H5NO 4(3H)-Pryidinone c9000059  
1727 C5H5NO 4-Pyridinol c626642  
1728 C6H5OH phenol phenol  
1729 C6H6O 2,4-Cyclohexadienone c24599573  
1730 C6H6O 2,5-Cyclohexadienone c5664335  
1731 C6H5SH Benzenethiol phsh  
1732 HO2CCHNH2CH2OH Serine serine  
1733 C5H8O2 Acetylacetone acac  
1734 C4H8O2S Sulfolane sulfolane  
1735 C7H10 Norbornene norbornene  
1736 CH(C2H3)3 trivinyl methane tvm  
1737 C6H10O cyclohexanone chexo  
1738 C6H12O hexanal c6h12o  
1739 C6H12O Oxepane oxepane  
1740 C3H7OC3H7 di-n-propyl ether propr  
1741 F2CCCF2 tetrafluoroallene pfa  
1742 CF3COO- trifluoro acetate anion cf3coo-  
1743 CF3COF trifluoroacetyl fluoride cf3cof  
1744 CF3COCl trifluoroacetyl chloride cf3cocl  
1745 PF6 Hexafluorophosphate neutral pf6  
1746 SF6 Sulfur Hexafluoride sf6  
1747 SeF6 Selenium hexafluoride sef6  
1748 SF5Cl sulfur chloropentafluoride sf5cl  
1749 CF3CHF2 pentafluoroethane cf3chf2  
1750 CF3CHFCl 1,1,1,2-tetrafluorochloroethane cf3chfcl  
1751 CF3CHCl2 1,1-Dichloro-2,2,2-trifluoroethane cf3chcl2  
1752 CHCl2CClF2 Ethane, 1,2,2-trichloro-1,1-difluoro- chcl2cclf2  
1753 CCl3CHCl2 pentachloroethane ccl3chcl2  
1754 C6H5F Fluorobenzene bzf  
1755 C6H5Cl chlorobenzene bzcl  
1756 C6H5Br bromobenzene bzbr  
1757 C8H6 Calicene calicene  
1758 C6H5CCH phenylacetylene phac  
1759 C8H6 benzocyclobutadiene bcbd  
1760 C8H6 Pentalene pentalene  
1761 C6H5CHCH2 Styrene styrene  
1762 C8H8 cubane cubane  
1763 C8H8 cyclooctatetraene cot  
1764 C6H5CH2CH3 Ethylbenzene etbz  
1765 CH3C6H4CH3 meta-xylene mxylene  
1766 CH3C6H4CH3 paraxylene pxylene  
1767 C8H14 Bicyclo[2.2.2]octane bico222  
1768 C8H16 cyclooctane cyclooct  
1769 (CH3)3CC(CH3)3 tetramethylbutane tmb  
1770 C8H18 Octane c8h18  
1771 C6H5CN phenyl cyanide phcn  
1772 C6H12N2 Triethylenediamine ted  
1773 C4O4-- squarate dianion c4o4--  
1774 S4N4 Tetrasulfur tetranitride s4n4  
1775 S8 Octasulfur s8  
1776 C6H4O2 parabenzoquinone pbq  
1777 C4H4N2O2 Uracil uracil  
1778 C6H5CHO benzaldehyde benzal  
1779 C6H5OCH3 Anisole anisole  
1780 C5H9NO2 Proline proline  
1781 C6H12O2 Methyl pivalate c598981  
1782 C6H12O2 Hexanoic acid hexa  
1783 C4F4 tetrafluorcyclobutadiene c4f4  
1784 Al2Cl6 Aluminum, di-μ-chlorotetrachlorodi- al2cl6  
1785 CF3CF2Cl pentafluorochloroethane cf3cf2cl  
1786 CF2ClCF2Cl 1,2-Dichloro-1,1,2,2-tetrafluoroethane cf2clcf2cl  
1787 CF3CFCl2 1,1-Dichlorotetrafluoroethane cf3cfcl2  
1788 CF2ClCFCl2 Ethane, 1,1,2-trichloro-1,2,2-trifluoro- cf2clcfcl2  
1789 CF3CCl3 1,1,1-trifluoro-2,2,2-trichloroethane cf3ccl3  
1790 C2F6 hexafluoroethane c2f6  
1791 C2Cl6 hexachloroethane c2cl6  
1792 IF7 Iodine heptafluoride if7  
1793 C6H4F2 metadifluorobenzene mdfb  
1794 C6H4F2 orthodifluorobenzene odfb  
1795 C6H4F2 1,4-difluorobenzene pdfb  
1796 C6H4Cl2 1,2-dichlorobenzene dcb12  
1797 C6H4Cl2 1,3-dichlorobenzene dcb13  
1798 C6H4Cl2 1,4-dichlorobenzene dcb14  
1799 C6H5NO nitrosobenzene bzno  
1800 C9H8 Indene indene  
1801 C9H8 spiro[4.4]nona-1,3,6,8-tetraene snt  
1802 C9H12 n-propyl benzene prbz  
1803 C9H20 Nonane nonane  
1804 C(CN)4 tetracyanomethane c5n4  
1805 C5H4N4 purine purine  
1806 C8H7N Indole indole  
1807 C3H3N3O3 cyanuric acid cyanuric  
1808 C6H5NO2 Nitrobenzene c6h5no2  
1809 C6H5COOH benzoic acid benzo  
1810 CH3COC6H5 acetophenone acph  
1811 C3Cl3N3 1,3,5-Triazine, 2,4,6-trichloro- c3cl3n3  
1812 C3F6 hexafluoropropene c3f6  
1813 C6H3F3 Benzene trifluoride 123 bzf3a  
1814 C8H18O 1-Octanol octanol  
1815 C10H8 Azulene azu  
1816 C10H8 naphthalene naph  
1817 C10H10 bullvalene bullv  
1818 C10H16 adamantane adamantane  
1819 C6N4 Tetracyanoethylene tcne  
1820 C6N4- tetracyanoethylene anion tcne-  
1821 C10H22 Decane decane  
1822 C4F6 perfluorobutadiene c4f6  
1823 SF5CF3 Sulfur, pentafluoro(trifluoromethyl)- sf5cf3  
1824 C3F8 perfluoropropane c3f8  
1825 Fe(CO)5 Iron pentacarbonyl ipc  
1826 Fe(C5H5)2 ferrocene fecp2  
1827 B12H12-- Dodecahydrododecaborate(2-) b12h12--  
1828 B12H12-- Dodecahydrododecaborate(2-) b12h12--  
1829 C12H8 Acenaphthylene acenaph  
1830 C12H8 biphenylene biph  
1831 C12H10 biphenyl biphenyl  
1832 C12H10 Heptalene heptalene  
1833 C6H12O6 Inositol inositol  
1834 C6F6 hexafluorobenzene c6f6  
1835 S2F10 disulphur decafluoride s2f10  
1836 C13H10 Fluorene fluorene  
1837 C14H10 Anthracene anth  
1838 C14H10 Phenanthrene phenanthrene  
1839 C14H14 Bibenzyl bibenzyl  
1840 C12H10N2 azobenzene azobenzene  
1841 C6H5COC6H5 benzophenone benzophenone  
1842 C16H10 Pyrene pyrene  
1843 C18H12 Tetracene tetracene  
1844 C19H16 Triphenylmethane tpm  
1845 C24H12 Coronene coronene  
1846 C60 Buckminsterfullerene c60