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List of which calculations are completed at CCD /cc-pCVDZ

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count Species Name State Conformation
1 Li Lithium atom 2SKh
2 Mg Magnesium atom 1SKh
3 BeH beryllium monohydride 2ΣC∞v
4 BeH2 beryllium dihydride 1ΣgD∞h
5 MgH2 magnesium dihydride 1ΣgD∞h
6 BH3 boron trihydride 1A1'D3h
7 SiH Silylidyne 2ΠC∞v
8 CH2 Methylene 3B1C2v
9 CH2 Methylene 1A1C2v
10 CH4 Methane 1A1Td
11 SiH4 Silane 1A1Td
12 PH3 Phosphine 1A1C3v
13 HS Mercapto radical 2ΠC∞v
14 H2O Water 1A1C2v
15 H2S Hydrogen sulfide 1A1C2v
16 H2S+ Hydrogen sulfide cation 2B1C2v
17 H3S+ Sulfonium cation 1A1C3v
18 HCl Hydrogen chloride 1ΣC∞v
19 HCl+ hydrogen chloride cation 2ΠC∞v
20 H2Cl+ dihydrogen monochloride cation 1A1C2v
21 Li2 Lithium diatomic 1ΣgD∞v
22 Na2 Sodium diatomic 1ΣgD∞h
23 LiB Lithium boride 3ΠC∞v
24 B2 Boron diatomic 3ΣgD∞h
25 C2H4 Ethylene 1AgD2h
26 C2H6 Ethane 1A1gD3d
27 Si2H6 disilane 1EuD3d
28 AlN Aluminum nitride 3ΠiC∞v
29 CN Cyano radical 2ΣC∞v
30 N2 Nitrogen diatomic 1ΣgD∞h
31 HCN Hydrogen cyanide 1ΣC∞v
32 NNH+ Dinitrogen monohydride cation 1ΣC∞v
33 N2H2 (E)-diazene 1AgC2h
34 MgO magnesium oxide 1Σ+C∞v
35 CaS Calcium sulfide 1ΣC∞v
36 BO boron monoxide 2ΣC∞v
37 CO Carbon monoxide 1ΣC∞v
38 CO- carbon monoxide anion 2ΠC∞v
39 CO+ carbon monoxide cation 2ΣC∞v
40 SiO Silicon monoxide 1ΣC∞v
41 NO Nitric oxide 2ΠC∞v
42 NS Mononitrogen monosulfide 2ΠC∞v
43 PO Phosphorus monoxide 2ΠC∞v
44 O2 Oxygen diatomic 3ΣgD∞h
45 SO Sulfur monoxide 3ΣC∞v
46 H2CS Thioformaldehyde 1A1C2v
47 CH3SH Methanethiol 1A'Cs
48 CH3SH2+ protonated methylsulfide 1A'Cs
49 LiF lithium fluoride 1ΣC∞v
50 LiCl lithium chloride 1ΣC∞v
51 NaF sodium fluoride 1ΣC∞v
52 NaCl Sodium Chloride 1ΣC∞v
53 BF Boron monofluoride 1ΣC∞v
54 AlF Aluminum monofluoride 1Σ+C∞v
55 CF Fluoromethylidyne 2ΠC∞v
56 NCl nitrogen monochloride 3ΣC∞v
57 ClO Monochlorine monoxide 2ΠC∞v
58 SCl sulfur monochloride 2ΠC∞v
59 F2 Fluorine diatomic 1ΣgD∞h
60 ClF Chlorine monofluoride 1Σ+C∞v
61 Cl2 Chlorine diatomic 1ΣgD∞h
62 Cl2+ chlorine diatomic cation 2ΠgD∞h
63 HOCl hypochlorous acid 1A'Cs
64 CH3Cl Methyl chloride 1A1C3v
65 CH2CCH2 allene 1A1D2d
66 Si3H8 trisilane   
67 N3 azide radical 2ΠgD∞h
68 HN3 hydrogen azide 1A'Cs
69 N2O Nitrous oxide 1ΣC∞v
70 CO2 Carbon dioxide 1ΣgD∞h
71 CS2 Carbon disulfide 1ΣgD∞h
72 NSO sulfinyl amidogen   
73 SNO Nitrogen oxide sulfide   
74 S3 Sulfur trimer 1A1C2v
75 BH3CO Borane carbonyl 1A1C3v
76 C2H4O Ethylene oxide 1A1C2v
77 FNO Nitrosyl fluoride 1A'Cs
78 FNS Thionitrosyl fluoride 1A'Cs
79 FSN Thiazyl fluoride 1A'Cs
80 CF2 Difluoromethylene 1A1D∞h
81 CF2 Difluoromethylene 3B1C2v
82 OClO Chlorine dioxide 2B1D∞h
83 ClSO Sulfur chloride oxide 2A"Cs
84 FClO chlorosyl fluoride 1A'Cs
85 ClOF Chlorine hypofluorite 1A'Cs
86 S2N2 Disulfur dinitride 1AGD2h
87 BF3 Borane, trifluoro- 1A'D3h
88 AlF3 Aluminum trifluoride 1A1'D3h
89 ClO2F Chloryl fluoride 1A'Cs
90 HClO4 perchloric acid 1ACs
91 SiF5- silicon pentafluoride anion   

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 h  
5 H- Hydrogen atom anion h-  
6 H+ Hydrogen atom cation h+  
7 D2 Deuterium diatomic d2  
8 H2 Hydrogen diatomic h2  
9 H2- hydrogen diatomic anion h2-  
10 H2+ Hydrogen cation h2+  
11 HD Deuterium hydride hd  
12 H3+ hydrogen trimer cation h3+  
13 He Helium atom he  
14 He- Helium atom anion he-  
15 He+ Helium atom cation he+  
16 HeH Helium hydride heh  
17 HeH+ Helium hydride cation heh+  
18 He2+ helium diatomic cation he2+  
19 Li- Lithium atom anion li-  
20 Li+ Lithium atom cation li+  
21 Na Sodium atom na  
22 Na- Sodium atom anion na-  
23 Na+ Sodium atom cation na+  
24 K Potassium atom k  
25 K- Potassium atom anion k-  
26 K+ Potassium atom cation k+  
27 Cu Copper atom cu  
28 Cu- Copper atom anion cu-  
29 Cu+ Copper atom cation cu+  
30 LiH Lithium Hydride lih  
31 LiH- lithium hydride anion lih-  
32 LiH+ lithium hydride cation lih+  
33 NaH sodium hydride nah  
34 NaH- sodium hydride anion nah-  
35 NaH+ sodium hydride cation nah+  
36 KH Potassium hydride kh  
37 KH+ Potassium hydrogen cation kh+  
38 CuH Copper monohydride cuh  
39 Be Beryllium atom be  
40 Be- Beryllium atom anion be-  
41 Be+ Beryllium atom cation be+  
42 Mg- Magnesium atom anion mg-  
43 Mg+ Magnesium atom cation mg+  
44 Ca Calcium atom ca  
45 Ca- Calcium atom anion ca-  
46 Ca+ Calcium atom cation ca+  
47 Zn Zinc atom zn  
48 Zn- Zinc atom anion zn-  
49 Zn+ Zinc atom cation zn+  
50 BeH- berylium monohydride anion beh-  
51 BeH+ beryllium monohydride cation beh+  
52 MgH magnesium monohydride mgh  
53 MgH- magnesium monohydride anion mgh-  
54 MgH+ magnesium monohydride cation mgh+  
55 CaH Calcium monohydride cah  
56 CaH+ Calcium monohydride cation cah+  
57 TiH Titanium monohydride tih  
58 ZnH Zinc monohydride znh  
59 ZnH+ Zinc, protonated znh+  
60 BeH2+ Beryllium dihydride cation beh2+  
61 CaH2 Calcium Hydride cah2  
62 ZnH2 Zinc hydride znh2  
63 B Boron atom b  
64 B- Boron atom anion b-  
65 B+ Boron atom cation b+  
66 Al Aluminum atom al  
67 Al- Aluminum atom anion al-  
68 Al+ Aluminum atom cation al+  
69 Sc Scandium atom sc  
70 Sc+ Scandium cation sc+  
71 Ga Gallium atom ga  
72 Ga- Gallium atom anion ga-  
73 Ga+ Gallium atom cation ga+  
74 BH Boron monohydride bh  
75 BH- boron monohydride anion bh-  
76 BH+ boron monohydride cation bh+  
77 AlH aluminum monohydride alh  
78 AlH- aluminum monohydride anion alh-  
79 AlH+ aluminum monohydride cation alh+  
80 ScH Scandium monohydride sch  
81 ScH+ Scandium monohydride cation sch+  
82 GaH Gallium monohydride gah  
83 GaH+ Gallium monohydride cation gah+  
84 BH2 boron dihydride bh2  
85 BH2- boron dihydride anion bh2-  
86 BH2+ Boron dihydride cation bh2+  
87 AlH2 aluminum dihydride alh2  
88 AlH2- aluminum dihydride anion alh2-  
89 AlH2+ aluminum dihydride cation alh2+  
90 BH3- boron trihydride anion bh3-  
91 BH3+ boron trihydride cation bh3+  
92 AlH3 aluminum trihydride alh3  
93 AlH3- aluminum trihydride anion alh3-  
94 AlH3+ aluminum trihydride cation alh3+  
95 ScH3 Scandium trihydride sch3  
96 GaH3 Gallium trihydride gah3  
97 BH4 borohydride bh4  
98 BH4- borohydride anion bh4-  
99 AlH4- Aluminum tetrahydride anion alh4-  
100 C Carbon atom c  
101 C- Carbon atom anion c-  
102 C+ Carbon atom cation c+  
103 Si Silicon atom si  
104 Si- Silicon atom anion si-  
105 Si+ Silicon atom cation si+  
106 Ti Titanium atom ti  
107 Ti- Titanium atom anion ti-  
108 Ti+ Titanium atom cation ti+  
109 Ge Germanium atom ge  
110 Ge- Germanium anion ge-  
111 Ge+ Germanium cation ge+  
112 Sn Tin atom sn  
113 Sn+ Tin cation sn+  
114 CH Methylidyne ch  
115 CH- methylidyne anion ch-  
116 CH+ Methylidyne cation ch+  
117 SiH- silicon monohydride anion sih-  
118 SiH+ silicon monohydride cation sih+  
119 GeH germylidene geh  
120 GeH+ Germaniun monohyrdide cation geh+  
121 CH2- methylene anion ch2-  
122 CH2+ methylene cation ch2+  
123 SiH2 silicon dihydride sih2  
124 SiH2- silicon dihydride anion sih2-  
125 SiH2+ silicon dihydride cation sih2+  
126 GeH2 germylene geh2  
127 GeH2- germylene anion geh2-  
128 CH3 Methyl radical ch3  
129 CH3- methyl anion ch3-  
130 CH3+ methyl cation ch3+  
131 SiH3 Silyl radical sih3  
132 SiH3- Silyl anion sih3-  
133 SiH3+ Silyl cation sih3+  
134 GeH3 Germyl radical geh3  
135 GeH3+ germyl cation geh3+  
136 CD4 methane-d4 cd4  
137 CH2D2 methane-d2 ch2d2  
138 CH3D methane-d ch3d  
139 CH4- Methane anion ch4-  
140 CH4+ Methane cation ch4+  
141 CHD3 methane-d3 chd3  
142 SiH2D2 silane-d2 sih2d2  
143 SiH4+ Silane cation sih4+  
144 GeH4 Germane geh4  
145 SnH4 Stannane snh4  
146 SiH5+ Silane, protonated sih5+  
147 N Nitrogen atom n  
148 N- Nitrogen atom anion n-  
149 N+ Nitrogen atom cation n+  
150 P Phosphorus atom p  
151 P- Phosphorus atom anion p-  
152 P+ Phosphorus atom cation p+  
153 V Vanadium atom v  
154 V+ Vanadium atom cation v+  
155 As Arsenic atomic as  
156 As- Arsenic anion as-  
157 As+ Arsenic cation as+  
158 Sb Antimony atom sb  
159 NH Imidogen nh  
160 NH- Imidogen anion nh-  
161 NH+ imidogen cation nh+  
162 PH phosphorus monohydride ph  
163 PH- phosphorus monohydride anion ph-  
164 PH+ phosphorus monohydride cation ph+  
165 AsH Arsenic monohydride ash  
166 AsH+ Arsenic monohydride cation ash+  
167 SbH Antimony monohydride sbh  
168 ND2 Amidogen-d2 nd2  
169 NH2 Amino radical nh2  
170 NH2- amino anion nh2-  
171 NH2+ Amino cation nh2+  
172 PH2 Phosphino radical ph2  
173 PH2- Phosphino anion ph2-  
174 PH2+ Phosphino cation ph2+  
175 AsH2 Arsenic dihydride ash2  
176 AsH2+ Arsenic dihydride cation ash2+  
177 ND3 Ammonia-d3 nd3  
178 NH3 Ammonia nh3  
179 NH3- Ammonia anion nh3-  
180 NH3+ ammonia cation nh3+  
181 PH3+ Phosphine cation ph3+  
182 AsH3 Arsine ash3  
183 AsH3+ Arsine cation ash3+  
184 SbH3 Stibine sbh3  
185 AsH4+ Arsonium ash4+  
186 NH4 Ammonium radical nh4  
187 NH4+ ammonium cation nh4+  
188 PH4 Phosphoranyl radical ph4  
189 PH4+ phosphonium cation ph4+  
190 O Oxygen atom o  
191 O- Oxygen atom anion o-  
192 O+ Oxygen atom cation o+  
193 S Sulfur atom s  
194 S- Sulfur atom anion s-  
195 S+ Sulfur atom cation s+  
196 Cr Chromium atom cr  
197 Se Selenium atom se  
198 Se- Selenium atom anion se-  
199 Se+ Selenium atom cation se+  
200 Te Tellurium atom te  
201 Te+ Tellurium atom cation te+  
202 DO Hydroxyl-d od  
203 OH Hydroxyl radical oh  
204 OH- hydroxide anion oh-  
205 OH+ hydoxyl cation oh+  
206 DS Mercapto-d ds  
207 HS- mercapto anion sh-  
208 HS+ sulfur monohydride cation sh+  
209 CrH Chromium hydride crh  
210 CrH+ Chromium hydride cation crh+  
211 HSe Selenium monohydride hse  
212 HSe- selenium monohydride anion hse-  
213 HSe+ selenium monohydride cation hse+  
214 TeH Telluryl radical teh  
215 D2O Deuterium oxide d2o  
216 H2O- water anion h2o-  
217 H2O+ water cation h2o+  
218 HDO Water-d1 hdo  
219 D2S Hydrogen sulfide-d2 d2s  
220 H2S- Hydrogen sulfide anion h2s-  
221 H2Se Hydrogen selenide h2se  
222 H2Se+ Hydrogen selenide cation h2se+  
223 H2Te Hydrogen Telluride h2te  
224 H3O+ hydronium cation h3o+  
225 H3Se+ Hydrogen Selenide, protonated h3se+  
226 F Fluorine atom f  
227 F- Fluorine atom anion f-  
228 F+ Fluorine atom cation f+  
229 Cl Chlorine atom cl  
230 Cl- Chlorine atom anion cl-  
231 Cl+ Chlorine atom cation cl+  
232 Mn Manganese atom mn  
233 Br Bromine atom br  
234 Br- Bromine atom anion br-  
235 Br+ Bromine atom cation br+  
236 I Iodine atom iodine  
237 I- Iodine atom anion iodine-  
238 I+ Iodine atom cation iodine+  
239 DF Hydrofluoric acid-d df  
240 HF Hydrogen fluoride hf  
241 HF- hydrogen fluoride anion hf-  
242 HF+ hydrogen fluoride cation hf+  
243 DCl Hydrochloric acid-d dcl  
244 HCl- hydrogen chloride anion hcl-  
245 HBr hydrogen bromide hbr  
246 HBr- hydrogen bromide anion hbr-  
247 HBr+ hydrogen bromide cation hbr+  
248 HI Hydrogen iodide hi  
249 HI+ Hydrogen iodide cation hi+  
250 H2F+ dihydrogen fluoride cation h2f+  
251 H2Br+ protonated hydrogen bromide h2br+  
252 H2I+ Iodonium h2i+  
253 Ne Neon atom ne  
254 Ne- Neon atom anion ne-  
255 Ne+ Neon atom cation ne+  
256 Ar Argon atom ar  
257 Ar- Argon atom anion ar-  
258 Ar+ Argon atom cation ar+  
259 Fe Iron atom fe  
260 Kr Krypton atom kr  
261 Kr+ Krypton cation kr+  
262 Xe Xenon atom xe  
263 HeLi+ Helium Lithium cation heli+  
264 NeH neon hydrogen neh  
265 NeH+ neon hydrogen cation neh+  
266 ArH+ Argon hydride cation arh+  
267 KrH+ Protonated Krypton krh+  
268 XeH+ Xenon, protonated xeh+  
269 H2Ar H2 Ar dimer h2ar  
270 Co Cobalt atom cobalt  
271 Ni Nickel atom ni  
272 Li2- lithium diatomic anion li2-  
273 Li2+ lithium diatomic cation li2+  
274 NaLi lithium sodium lina  
275 NaLi- lithium sodium anion lina-  
276 NaLi+ lithium sodium cation lina+  
277 LiK Lithium Potassium lik  
278 Na2- sodium diatomic anion na2-  
279 Na2+ sodium diatomic cation na2+  
280 NaK Sodium Potassium nak  
281 NaK+ Sodium Potassium diatomic cation nak+  
282 K2 Potassium diatomic k2  
283 Cu2 Copper diatomic cu2  
284 LiBe Lithium Beryllium libe  
285 LiMg Lithium magnesium limg  
286 NaBe Sodium Beryllium nabe  
287 NaMg Sodium Magnesium namg  
288 Be2 Beryllium diatomic be2  
289 Be2- Beryllium diatomic anion be2-  
290 Be2+ Beryllium diatomic cation be2+  
291 BeMg Beryllium Magnesium bemg  
292 Mg2 Magnesium diatomic mg2  
293 Mg2- magnesium diatomic anion mg2-  
294 Mg2+ magnesium diatomic cation mg2+  
295 Ca2 Calcium diatomic ca2  
296 LiAl Lithium Aluminum lial  
297 NaAl Sodium aluminum naal  
298 BeB Beryllium monoboride beb  
299 B2- Boron diatomic anion b2-  
300 B2+ Boron diatomic cation b2+  
301 BAl Boron Aluminum bal  
302 Al2 Aluminum diatomic al2  
303 Al2- aluminum diatomic anion al2-  
304 Al2+ aluminum diatomic cation al2+  
305 BGa Boron Gallium bga  
306 AlGa Aluminum Gallium alga  
307 Ga2 Gallium diatomic ga2  
308 HBBH Diborane(2) hbbh  
309 LiBH4 Lithium borohydride libh4  
310 B2H4 Diborane(4) D2d b2h4  
311 HBHHBH Diborane(4) C2V hbhhbh  
312 B2H6 Diborane b2h6  
313 B2H6+ Diborane cation b2h6  
314 Al2H6 dialane al2h6  
315 Ga2H6 digallane ga2h6  
316 LiC Lithium Carbide lic  
317 BeC Beryllium Carbide bec  
318 CaC Calcium monocarbide cac  
319 BC boron monocarbide bc  
320 BC- boron monocarbide anion bc-  
321 BC+ boron monocarbide cation bc+  
322 AlC Aluminum carbide alc  
323 BSi Boron silicide bsi  
324 C2 Carbon diatomic c2  
325 C2- carbon diatomic anion c2-  
326 C2+ carbon diatomic cation c2+  
327 SiC silicon monocarbide sic  
328 SiC- silicon monocarbide anion sic-  
329 SiC+ silicon monocarbide cation sic+  
330 Si2 Silicon diatomic si2  
331 Si2- silcon diatomic anion si2-  
332 Si2+ silcon diatomic cation si2+  
333 GeC Germanium monocarbide gec  
334 SiGe Silicon Germanium sige  
335 Ge2 Germanium diatomic ge2  
336 C2H Ethynyl radical c2h  
337 C2H- Ethynyl anion c2h-  
338 C2H+ Ethynyl cation c2h+  
339 ZnCH2 Zinc methylene znch2  
340 C2H2 Acetylene c2h2  
341 C2H2+ acetylene cation c2h2+  
342 CCH2 vinylidene vinylidene  
343 H2CC- vinylidene anion h2cc-  
344 HCCH- acetylene anion c2h2-  
345 Si2H2 disilyne si2h2  
346 CH3Li methyl lithium ch3li  
347 CuCH3 monomethyl copper cuch3  
348 ZnCH3 Zinc monomethyl znch3  
349 CH2BH methyleneborane ch2bh  
350 C2H3 vinyl c2h3  
351 C2H3- vinyl anion c2h3-  
352 C2H3+ vinyl cation c2h3+  
353 C2H4- Ethylene anion c2h4-  
354 C2H4+ Ethylene cation c2h4+  
355 CH3CH methylmethylene ch3ch  
356 CH2SiH2 silaethylene ch2sih2  
357 Si2H4 Disilene si2h4  
358 CH3BH2 methylborane ch3bh2  
359 C2H5 Ethyl radical c2h5  
360 C2H5- Ethyl anion c2h5-  
361 C2H5+ Ethyl cation c2h5+  
362 C2H6+ ethane cation c2h6+  
363 CH3SiH3 methyl silane ch3sih3  
364 GeH3CH3 methyl germane geh3ch3  
365 C2H7+ Ethane, protonated c2h7+  
366 LiN Lithium Nitride lin  
367 LiN+ Lithium Nitride cation lin+  
368 LiP Lithium monophosphide lip  
369 BeN Beryllium mononitride ben  
370 BeN- Beryllium mononitride anion ben-  
371 BeN+ Beryllium mononitride cation ben+  
372 MgN Magnesium Nitride mgn  
373 BN- boron nitride anion bn-  
374 AlN- aluminum mononitride anion aln-  
375 AlN+ aluminum mononitride cation aln+  
376 BP Boron monophosphide bp  
377 AlP Aluminum monophosphide alp  
378 GaN Gallium mononitride gan  
379 GaP Gallium monophosphide gap  
380 GaAs Gallium arsenide gaas  
381 BN boron nitride bn  
382 BN+ boron nitride cation bn+  
383 CN- cyanide anion cn-  
384 CN+ Cyano cation cn+  
385 CP Carbon monophosphide cp  
386 CP- carbon monophosphide anion cp-  
387 CP+ carbon monophosphide cation cp+  
388 SiN Silicon nitride sin  
389 SiN- silicon mononitride anion sin-  
390 SiN+ silicon mononitride cation sin+  
391 SiP Silicon monophosphide sip  
392 SiP- Silicon monophosphide anion sip-  
393 SiP+ Silicon monophosphide cation sip+  
394 TiN Titanium mononitride tin  
395 N2- nitrogen diatomic anion n2-  
396 N2+ diatomic nitrogen cation n2+  
397 PN Phosphorus mononitride pn  
398 PN- phosphorus nitride anion pn-  
399 PN+ phosphorus nitride cation pn+  
400 P2 Phosphorus diatomic p2  
401 P2- phosphorus diatomic anion p2-  
402 P2+ phosphorus diatomic cation p2+  
403 AsN Arsenic mononitride asn  
404 AsP Arsenic monophosphide asp  
405 SbN Antimony nitride sbn  
406 As2 Arsenic diatomic as2  
407 HNB hydrogen nitrogen boron hnb  
408 HNC hydrogen isocyanide hnc  
409 HCN- Hydrogen cyanide anion hcn-  
410 HCN+ hydrogen cyanide cation hcn+  
411 HNC+ hydrogen isocyanide cation hnc+  
412 HCP Phosphaethyne hcp  
413 HCP+ Phosphaethyne cation hcp+  
414 NNH Dinitrogen monohydride nnh  
415 HPO Hydrogen phosphorus oxide hpo  
416 HPO+ Hydrogen phosphorus oxide cation hpo+  
417 LiNH2 lithium amide linh2  
418 HBNH Boranimine hbnh  
419 CNH2 Aminomethylidyne radical cnh2  
420 CNH2+ N-protonated hydrogen isocyanide cnh2+  
421 H2CN Dihydrogen cyanide radical h2cn  
422 H2CN+ hydrocyanonium cation h2cn+  
423 HCNH methyleneazane hcnh  
424 HCNH+ N-protonated HCN hcnh+  
425 H2NN Isodiazene h2nn  
426 N2H2 (Z)-Diazene n2h2z  
427 N2H2+ trans-diazene cation n2h2+  
428 CH2NH Methanimine ch3n  
429 CH2NH+ Methanimine cation ch2nh+  
430 CHNH2 aminomethylene chnh2  
431 CHNH2+ Aminocarbene cation chnh2+  
432 CH2PH Phosphaethene ch3p  
433 BH2NH2 Boranamine bh2nh2  
434 CH2NH2+ methyleneamine cation ch2nh2+  
435 N2H4 Hydrazine n2h4  
436 N2H4+ hydrazine cation n2h4+  
437 P2H4 Diphosphine p2h4  
438 CH3NH2 methyl amine ch3nh2  
439 CH3NH2+ methyl amine cation ch3nh2+  
440 CH3PH2 Methyl phosphine ch3ph2  
441 SiH3NH2 Silane, amino sih3nh2  
442 N2H5+ protonated hydrazine n2h5+  
443 BH3PH3 borane phosphine bh3ph3  
444 BH3NH3 borane ammonia bh3nh3  
445 CH3NH3 methyl ammonium radical ch3nh3  
446 CH3NH3+ protonated methylamine ch3nh3+  
447 CH3PH3+ methyl phosphine, protonated ch3ph3+  
448 NH3NH3 Ammonia Dimer nh3nh3  
449 N2H7+ ammonia ammonium dimer n2h7+  
450 LiO lithium oxide lio  
451 LiO- lithium oxide anion lio-  
452 LiO+ lithium oxide cation lio+  
453 LiS Lithium monosulfide lis  
454 LiS+ Lithium sulfide cation lis+  
455 NaO sodium monoxide nao  
456 NaO- sodium oxide anion nao-  
457 NaO+ sodium oxide cation nao+  
458 KO Potassium monoxide ko  
459 KO+ Potassium monoxide cation ko+  
460 NaS Sodium sulfide nas  
461 CuO Copper Monoxide cuo  
462 LiSe Lithium monoselenide lise  
463 BeO beryllium oxide beo  
464 BeO- Beryllium monoxide anion beo-  
465 BeO+ Beryllium monoxide cation beo+  
466 BeS beryllium sulfide bes  
467 MgO- magnesium oxide anion mgo-  
468 MgO+ magnesium oxide cation mgo+  
469 CaO Calcium monoxide cao  
470 MgS magnesium sulfide mgs  
471 MgS- magnesium sulfide anion mgs-  
472 MgS+ magnesium sulfide cation mgs+  
473 ZnO zinc monoxide zno  
474 ZnS Zinc sulfide zns  
475 BeS- Beryllium monosulfide anion bes-  
476 BeS+ Beryllium monosulfide cation bes+  
477 BO- boron monoxide anion bo-  
478 AlO Aluminum monoxide alo  
479 AlO- Aluminum monoxide anion alo-  
480 AlO+ aluminum monoxide cation alo+  
481 BS boron sulfide bs  
482 BS- boron monosulfide anion bs-  
483 BS+ boron monosulfide cation bs+  
484 AlS Aluminum sulfide als  
485 AlS- aluminum monosulfide anion als-  
486 AlS+ aluminum monosulfide cation als+  
487 ScO Scandium monoxide sco  
488 GaO Gallium monoxide gao  
489 GaS Gallium monosulfide gas  
490 BO+ boron monoxide cation bo+  
491 CS carbon monosulfide cs  
492 CS- carbon monosulfide anion cs-  
493 CS+ carbon monosulfide cation cs+  
494 SiO- silicon monoxide anion sio-  
495 SiO+ silicon monoxide cation sio+  
496 SiS silicon monosulfide sis  
497 SiS- silicon monosulfide anion sis-  
498 SiS+ silicon monosulfide cation sis+  
499 TiO Titanium monoxide tio  
500 CSe Carbon monoselenide cse  
501 CSe- Carbon monoselenide anion cse-  
502 CSe+ Carbon monoselenide cation cse+  
503 GeO Germanium monoxide geo  
504 GeO+ Germanium monoxide cation geo+  
505 GeS Germanium monosulfide ges  
506 SiSe Silicon Monoselenide sise  
507 SiSe+ Silicon Monoselenide cation sise+  
508 GeSe Germanium monoselenide gese  
509 NO- nitric oxide anion no-  
510 NO+ nitric oxide cation no+  
511 NS- nitrogen sulfide anion ns-  
512 NS+ nitrogen sulfide cation ns+  
513 PO- phosphorus monoxide anion po-  
514 PO+ phosphorus monoxide cation po+  
515 PS phosphorus sulfide ps  
516 PS- phosphorus monosulfide anion ps-  
517 PS+ phosphorus monosulfide cation ps+  
518 VO Vanadium monoxide vo  
519 AsO Arsenic monoxide aso  
520 NSe Nitrogen monoselenide nse  
521 AsS Arsenic monosulfide ass  
522 PSe Phosphorus monoselenide pse  
523 AsSe Arsenic monoselenide asse  
524 O2- oxygen diatomic anion o2-  
525 O2-- dioxygen dianion o2--  
526 O2+ diatomic oxygen cation o2+  
527 SO- sulfur monoxide anion so-  
528 SO+ sulfur monoxide cation so+  
529 S2 Sulfur diatomic s2  
530 S2- sulfur diatomic anion s2-  
531 S2+ sulfur diatomic cation s2+  
532 SeO Selenium monoxide seo  
533 SeO- selenium monoxide anion seo-  
534 SeO+ selenium monoxide cation seo+  
535 SeS Selenium monosulfide ses  
536 SeS- selenium monosulfide anion ses-  
537 SeS+ selenium monosulfide cation ses+  
538 TeO Tellurium monoxide teo  
539 Se2 Selenium diatomic se2  
540 Se2- selenium diatomic anion se2-  
541 Se2+ selenium diatomic cation se2+  
542 Te2 Tellurium diatomic te2  
543 LiOH lithium hydroxide lioh  
544 NaOH sodium hydroxide naoh  
545 KOH Potassium hydroxide koh  
546 BeOH beryllium monohydroxide beoh  
547 MgOH magnesium hydroxide mgoh  
548 CaOH Calcium monohydroxide caoh  
549 HBO Boron hydride oxide hbo  
550 HBS hydrogen boron sulfide hbs  
551 COH Hydroxymethylidyne coh  
552 COH+ Carbon Monoxide, protonated coh+  
553 HCO Formyl radical hco  
554 HCO- formyl anion hco-  
555 HCO+ Formyl cation hco+  
556 HCS Thioformyl radical hcs  
557 HCS- Thioformyl anion hcs-  
558 HCS+ Thioformyl cation hcs+  
559 HNO Nitrosyl hydride hno  
560 HNO- Nitrosyl hydride anion hno-  
561 HNO+ Nitrosyl hydride cation hno+  
562 NOH Hydroxyimidogen noh  
563 NOH+ O-protonated nitric oxide noh+  
564 HNS Sulfur imide hns  
565 HNS- Sulfur imide anion hns-  
566 HO2 Hydroperoxy radical ho2  
567 HO2- Hydroperoxy anion ho2-  
568 HO2+ Hydroperoxy cation ho2+  
569 HSO+ Sulfur Monoxide, S-protonated HSO+  
570 SOH Sulfur Hydroxide soh  
571 SOH+ Sulfur Monoxide, protonated soh+  
572 HS2 Thiosulfeno radical hs2  
573 H2CO Formaldehyde h2co  
574 H2CO- formaldehyde anion h2co-  
575 H2CO+ formaldehyde cation h2co+  
576 HOCH hydroxycarbene hoch  
577 H2CS- thioformaldehyde anion h2cs-  
578 H2CS+ thioformaldehyde cation h2cs+  
579 H2CSe Selenoformaldehyde h2cse  
580 H2NO nitroxide h2no  
581 H2O2 Hydrogen peroxide h2o2  
582 H2O2+ Hydrogen peroxide cation h2o2+  
583 H2OO water oxide h2oo  
584 HOSH hydrogen thioperoxide hosh  
585 H2S2 Disulfane h2s2  
586 H2S2+ hydrogen disulfide cation h2s2+  
587 H2Se2 hydrogen diselenide h2se2  
588 CH2OH Hydroxymethyl radical ch2oh  
589 CH2OH+ hydroxymethyl cation ch2oh+  
590 CH3O Methoxy radical ch3o  
591 CH3O- methoxy anion ch3o-  
592 CH3O+ Methoxy cation ch3o+  
593 CH3S thiomethoxy ch3s  
594 H2CSH+ Thioformaldehyde, protonated h2csh+  
595 NH2OH hydroxylamine nh2oh  
596 NH2OH+ Hydroxylamine cation nh2oh+  
597 NH3O Ammonia Oxide nh3o  
598 H2POH Phosphinous acid h2poh  
599 H3PO Phosphine oxide h3po  
600 NH2SH Thiohydroxylamine nh2sh  
601 NH3S sulfidoazane nh3s  
602 H3O2+ hydrogen peroxide, protonated h3o2+  
603 CH3OH Methyl alcohol ch3oh  
604 CH3OH- Methyl alcohol anion ch3oh-  
605 CH3OH+ Methyl alcohol cation ch3oh+  
606 CH3SH+ Methanethiol cation ch3sh+  
607 SiH3OH silanol sih3oh  
608 CH3SeH Methane selenol ch3seh  
609 NH2OH2+ protonated hydroxylamine nh2oh2+  
610 NH3OH+ N-protonated hydroxylamine nh3oh+  
611 H2OH2O water dimer h2oh2o  
612 CH3OH2+ Methanol, protonated ch3oh2+  
613 H2ONH3 Water Ammonia Dimer h2onh3  
614 H5O2+ Dihydroxonium ion h5o2+  
615 LiCl- lithium chloride anion licl-  
616 LiCl+ lithium chloride cation licl+  
617 NaF- sodium fluoride anion naf-  
618 NaF+ sodium fluoride cation naf+  
619 KF Potassium Fluoride kf  
620 NaCl- sodium chloride anion nacl-  
621 NaCl+ sodium chloride cation nacl+  
622 KCl Potassium Chloride kcl  
623 CuF Copper monofluoride cuf  
624 LiBr Lithium Bromide libr  
625 LiBr- lithium bromide anion libr-  
626 LiBr+ lithium bromide cation libr+  
627 CuCl Copper monochloride cucl  
628 NaBr Sodium Bromide nabr  
629 NaBr- sodium bromide anion nabr-  
630 NaBr+ sodium bromide cation nabr+  
631 KBr Potassium Bromide kbr  
632 LiI Lithium Iodide lii  
633 NaI Sodium Iodide nai  
634 KI Potassium Iodide ki  
635 LiF- lithium fluoride anion lif-  
636 LiF+ lithium fluoride cation lif+  
637 BeF Beryllium monofluoride bef  
638 BeF- Beryllium monofluoride anion bef-  
639 BeF+ Beryllium monofluoride cation bef+  
640 BeCl beryllium monochloride becl  
641 MgF Magnesium monofluoride mgf  
642 MgF- magnesium fluoride anion mgf-  
643 MgF+ magnesium fluoride cation mgf+  
644 CaF Calcium monofluoride caf  
645 MgCl magnesium monochloride mgcl  
646 MgCl- magnesium monochloride anion mgcl-  
647 MgCl+ magnesium monochloride cation mgcl+  
648 CaCl calcium monochloride cacl  
649 TiCl Titanium Monochloride ticl  
650 ZnF Zinc monofluoride znf  
651 ZnF- Zinc monofluoride anion znf-  
652 ZnF+ Zinc monofluoride cation znf+  
653 ZnCl Zinc monochloride zncl  
654 CaBr Calcium monobromide cabr  
655 BeCl- beryllium monochloride anion becl-  
656 BeCl+ beryllium monochloride cation becl+  
657 BF- Boron monofluoride anion bf-  
658 BF+ Boron monofluoride cation bf+  
659 AlF- Aluminum monofluoride anion alf-  
660 AlF+ Aluminum monofluoride cation alf+  
661 BCl boron monochloride bcl  
662 BCl- boron monochloride anion bcl-  
663 BCl+ boron monochloride cation bcl+  
664 AlCl Aluminum monochloride alcl  
665 AlCl- aluminum monochloride anion alcl-  
666 AlCl+ aluminum monochloride cation alcl+  
667 ScF Scandium monofluoride scf  
668 BBr Boron monobromide bbr  
669 GaF Gallium monofluoride gaf  
670 GaF+ Gallium monofluoride cation gaf+  
671 AlBr Aluminum monobromide albr  
672 GaCl Gallium monochloride gacl  
673 GaCl+ Gallium monochloride cation gacl+  
674 AlI Aluminum monoiodide ali  
675 GaBr Gallium monobromide gabr  
676 CF- carbon monofluoride anion cf-  
677 CF+ carbon monofluoride cation cf+  
678 CCl carbon monochloride ccl  
679 CCl- carbon monochloride anion ccl-  
680 CCl+ carbon monochloride cation ccl+  
681 SiF silicon monofluoride sif  
682 SiF- silicon monofluoride anion sif-  
683 SiF+ silicon monofluoride cation sif+  
684 SiCl Clorosilylidyne sicl  
685 SiCl- silicon monochloride anion sicl-  
686 SiCl+ silicon monochloride cation sicl+  
687 CBr Carbon monobromide cbr  
688 GeF Germanium monofluoride gef  
689 GeF+ Germanium monofluoride cation gef+  
690 GeCl Germanium monochloride gecl  
691 GeCl+ Germanium monochloride cation gecl+  
692 SiBr Silicon monobromide sibr  
693 SiBr+ Silicon monobromide cation sibr+  
694 NF nitrogen fluoride nf  
695 NF- nitrogen monofluorine anion nf-  
696 NF+ nitrogen monofluoirde cation nf+  
697 NCl- nitrogen monochloride anion ncl-  
698 NCl+ nitrogen monochloride cation ncl+  
699 PF phosphorus monofluoride pf  
700 PF- phosphorus monofluoride anion pf-  
701 PF+ phosphorus monofluoride cation pf+  
702 PCl phosphorus chloride pcl  
703 PCl- phosphorus monochloride anion pcl-  
704 PCl+ phosphorus monochloride cation pcl+  
705 AsF Arsenic monofluoride asf  
706 NBr nitrogen monobromide nbr  
707 AsCl Arsenic monochloride ascl  
708 PBr Phosphorus monobromide pbr  
709 SbF Antimony monofluoride sbf  
710 SbCl Antimony monochloride sbcl  
711 FO Oxygen monofluoride fo  
712 FO- flourine oxide anion fo-  
713 FO+ fluorine monoxide cation fo+  
714 ClO- chlorine monoxide anion clo-  
715 ClO+ chlorine monoxide cation clo+  
716 SF Monosulfur monofluoride sf  
717 SF- sulfur monofluoride anion sf-  
718 SF+ sulfur monofluoride cation sf+  
719 SCl- sulfur monochloride anion scl-  
720 SCl+ sulfur monochloride cation scl+  
721 BrO Bromine monoxide bro  
722 BrO- Bromine monoxide anion bro-  
723 BrO+ Bromine monoxide cation bro+  
724 SeF Selenium monofluoride sef  
725 SBr Sulfur monobromide radical sbr  
726 SBr+ Sulfur monobromide cation sbr+  
727 SeCl Selenium monochloride secl  
728 IO Iodine monoxide io  
729 SeBr Selenium monobromide sebr  
730 BrCl Bromine monochloride brcl  
731 F2- flourine diatomic anion f2-  
732 F2+ flourine diatomic cation f2+  
733 ClF- clorine monofluoride anion clf-  
734 ClF+ clorine monofluoride cation clf+  
735 Cl2- chlorine diatomic anion cl2-  
736 BrF Bromine monofluoride brf  
737 BrF- bromine fluoride anion brf-  
738 BrF+ bromine fluoride cation brf+  
739 BrCl- bromine chloride anion brcl-  
740 BrCl+ bromine chloride cation brcl+  
741 IF Iodine monofluoride if  
742 Br2 Bromine diatomic br2  
743 Br2- bromine diatomic anion br2-  
744 Br2+ bromine diatomic cation br2+  
745 ICl Iodine monochloride icl  
746 IBr Iodine monobromide ibr  
747 I2 Iodine diatomic i2  
748 I2+ Iodine diatomic cation i2+  
749 HCF Fluoromethylene hcf  
750 HCCl Chloromethylene hccl  
751 HSiF fluorosilylene hsif  
752 HSiCl Chlorosilylene hsicl  
753 HSiBr monobromosilylene hsibr  
754 CHBr bromomethylene chbr  
755 HOF Hypofluorous acid hfo  
756 DOCl Hypochlorous acid-d docl  
757 HOCl+ hypochlorous acid cation hocl+  
758 HOBr Hypobromous acid hobr  
759 HOBr+ Hypobromous acid cation hobr+  
760 HOI Hypoiodous acid hoi  
761 F2H+ Fluorine, protonated f2h+  
762 FHF Hydrogen difluoride fhf  
763 FHF- Hydrogen difluoride anion fhf-  
764 ClFH+ Chlorine fluoride, F-protonated clfh+  
765 FClH+ Chlorine fluoride, Cl-protonated fclh+  
766 Cl2H+ Chlorine, protonated cl2h+  
767 CH2Br bromomethyl radical ch2br  
768 CH2F fluoromethyl radical ch2f  
769 CH2F+ fluoromethyl cation ch2f+  
770 CH2Cl+ chloromethyl cation ch2cl+  
771 CH2Cl chloromethyl radical ch2cl  
772 NH2F monofluoroamine nh2f  
773 NH2Cl chloramine nh2cl  
774 H2F2 Hydrogen fluoride dimer h2f2  
775 CH3F+ methyl fluoride cation ch3f+  
776 CD3F methylfluoride-d3 cd3f  
777 CH3F Methyl fluoride ch3f  
778 CD3Cl methyl chloride d3 cd3cl  
779 CH3Cl+ Methyl chloride cation ch3cl+  
780 SiH3F monofluorosilane sih3f  
781 SiH3Cl chlorosilane sih3cl  
782 CH3Br methyl bromide ch3br  
783 GeH3F monofluorogermane geh3f  
784 GeH3Cl monochlorogermane geh3cl  
785 SiH3Br bromosilane sih3br  
786 CH3I methyl iodide ch3i  
787 SiH3I Silyl Iodide sih3i  
788 NH3Cl+ protonated monochloroammonia nh3cl+  
789 CH3ClH+ methyl chloride, protonated ch3clh+  
790 NH4Cl Ammonium chloride nh4cl  
791 LiNe+ Lithium Neon cation line+  
792 Ne2 Neon diatomic ne2  
793 Ne2+ Neon diatomic cation ne2+  
794 Ar2 Argon diatomic ar2  
795 Ar2+ Argon diatomic cation ar2+  
796 Li3 Lithium trimer li3  
797 Li3+ Lithium trimer cation li3+  
798 C3 carbon trimer c3  
799 C3+ carbon trimer cation c3+  
800 SiC2 Silicon dicarbide sic2  
801 C3H3 cyclopropenyl radical cpr  
802 C3H3 Propargyl radical propargyl  
803 C3H3- Propargyl anion c3h3-  
804 C3H3+ cyclopropenyl cation cpr+  
805 C3H3+ Propargyl cation c3h3+  
806 C3H4 cyclopropene cprop  
807 CH3CCH propyne propyne  
808 C3H5 Allyl radical allyl  
809 C3H5+ Allyl cation allyl+  
810 CH3CHCH 1-propenyl radical ch3chch  
811 Zn(CH3)2 dimethyl zinc dmz  
812 C3H6 Cyclopropane c3h6  
813 CH2CHCH3 Propene propene  
814 C3H7 n-Propyl radical npropyl  
815 C3H7+ cyclopropane, protonated c3h7+  
816 CH3CHCH3 Isopropyl radical isopropyl  
817 CH3CHCH3+ Isopropyl cation prop2yl+  
818 C3H8 Propane propane  
819 SiH2(CH3)2 dimethylsilane dms  
820 LiCN lithium cyanide licn  
821 NaCN Sodium Cyanide nacn  
822 KCN Potassium cyanide kcn  
823 CuCN Copper cyanide cucn  
824 ZnCN Zinc monocyanide zncn  
825 ZnNC Zinc isocyanide znnc  
826 AlCN Aluminum monocyanide alcn  
827 AlNC Aluminum isocyanide alnc  
828 CN2 3H-Diazirin-3-ylidene cn2  
829 CNN Diazocarbene cnn  
830 NCN Cyanoimidogen ncn  
831 N3- azide anion n3-  
832 N3+ azide cation n3+  
833 HCCN cyanomethylene hccn  
834 HCNN diazomethyl radical hcnn  
835 HN3+ Hydrazoic acid cation hn3+  
836 HNCNH diiminomethane hncnh  
837 CH2N2 diazirine ch2n2  
838 CH2NN diazomethane ch2nn  
839 NH2CN cyanamide cyanamide  
840 HNNNH+ 1,2-Triazadienium n2h3+  
841 NH2NN+ hydrazoic acid, protonated nh2nn+  
842 CH3CN Acetonitrile ch3cn  
843 CH3CN- acetonitrile anion ch3cn-  
844 CH3CN+ Acetonitrile cation ch3cn+  
845 CH3NC methyl isocyanide ch3nc  
846 CHNCH2 2H-Azirine c157164  
847 CHNHCH 1H-Azirine chnhch  
848 H2CCNH Ethenimine ch2cnh  
849 H2CNCH methyleneaminomethylene ch2nch  
850 HCCNH2 Ethynamine hccnh2  
851 HCNCH2+ 2H-Azirine cation hcnch2+  
852 HNCNH2+ diiminomethane, protonated hncnh2+  
853 NCNH3+ Cyanamide, protonated ncnh3+  
854 NH2CNH+ cyanamide, cn protonated nh2cnh+  
855 NH3CN+ cyanamide, amine protonated nh3cn+  
856 CH2CHNH vinylazine ch2chnh  
857 CH3CHN methylmethaniminyl radical ch3chn  
858 NHCHNH2 aminomethanimine cn2h4  
859 C2H5N Aziridine c2h5n  
860 CH2CHNH2 aminoethene aminoethene  
861 CH2NCH3 N-methylmethanimine nmm  
862 CH3CHNH ethanimine ethanimine  
863 NH2BHNH2 diaminoborane nh2bhnh2  
864 C2H5NH+ Protonated Aziridine c2h5nh+  
865 C2H6N+ aziridine, protonated c2h6n+  
866 NH2CH2NH2 diaminomethane nh2ch2nh2  
867 CH3CH2NH2 Ethylamine etam  
868 CH3NHCH3 Dimethylamine ch3nhch3  
869 CH3PHCH3 dimethylphosphine ch3phch3  
870 NH2CH2NH3+ diaminoethane, protonated pdam  
871 (CH3)2NH2+ dimethylammonium cation dmam  
872 CH3CH2NH3+ ethylamine, protonated pea  
873 Li2O dilithium oxide li2o  
874 Li2O+ dilithium oxide cation li2o+  
875 Li2S dilithium sulfide li2s  
876 Na2O disodium monoxide na2o  
877 Na2S Sodium sulfide na2s  
878 LiO2 Lithium dioxide lio2  
879 NaO2 Sodium superoxide nao2  
880 CCO Dicarbon monoxide cco  
881 CNO- fulminate cno-  
882 NCO isocyanato radical nco  
883 NCO- cyanate nco-  
884 SCN thiocyanato radical scn  
885 SCN- thiocyanide anion scn-  
886 BO2 Boron dioxide bo2  
887 BO2- Boron dioxide anion bo2-  
888 BO2+ Boron dioxide cation bo2+  
889 N2O- Nitrous oxide anion n2o-  
890 N2O+ Nitrous oxide cation n2o+  
891 NNS Nitrogen sulfide nns  
892 PPO Phosphorus oxide phosphide ppo  
893 CO2- Carbon dioxide anion co2-  
894 CO2+ Carbon dioxide cation co2+  
895 OCS Carbonyl sulfide cos  
896 OCS+ Carbonyl sulfide cation cos+  
897 SiO2 silicon dioxide sio2  
898 CS2- Carbon disulfide anion cs2-  
899 CS2+ Carbon disulfide cation cs2+  
900 TiO2 Titanium dioxide tio2  
901 SiS2 Silicon disulfide sis2  
902 GeO2 Germanium dioxide geo2  
903 OCSe Carbonyl selenide ocse  
904 SCSe Carbon sulfide selenide scse  
905 GeS2 Germanium disulfide ges2  
906 CSe2 Carbon diselenide cse2  
907 SCTe Carbon sulfide Telluride scte  
908 NO2 Nitrogen dioxide no2  
909 NO2- Nitrogen dioxide anion no2-  
910 NO2+ Nitrogen dioxide cation no2+  
911 PO2 Phosphorus dioxide po2  
912 PO2- Phosphorus dioxide anion po2-  
913 PO2+ Phosphorus dioxide cation po2+  
914 AsO2 Aresenic dioxide aso2  
915 O3 Ozone o3  
916 O3- Ozone anion o3-  
917 O3+ Ozone cation o3+  
918 SO2 Sulfur dioxide so2  
919 SO2- Sulfur dioxide anion so2-  
920 SO2+ Sulfur dioxide cation so2+  
921 SSO Disulfur monoxide sso  
922 S3- Sulfur trimer anion s3-  
923 S3+ Sulfur trimer cation s3+  
924 SeO2 Selenium dioxide seo2  
925 SeO2+ Selenium dioxide cation seo2+  
926 TeO2 Tellurium Dioxide teo2  
927 HCCO ketenyl radical ketenyl  
928 CS2H+ Carbon disulfide, protonated cs2h+  
929 HCNO fulminic acid hcno  
930 HNCO Isocyanic acid hnco  
931 HOCN cyanic acid hocn  
932 HNCS Isothiocyanic acid hncs  
933 HSCN thiocyanic acid hscn  
934 HCO2- formate anion hco2-  
935 HNNO nitrosoazane hnno  
936 HNNO+ Nitrous oxide, N-protonated hnno+  
937 NNOH+ Nitrous Oxide, O-protonated nnoh+  
938 HCOO formate neutral radical hcoo  
939 HOCO Hydrocarboxyl radical hoco  
940 HOCO+ Hydrocarboxyl cation hoco+  
941 HNO2 Nitrous acid hno2  
942 HNO2+ nitrous acid cation hno2+  
943 O3H+ protonated ozone o3h+  
944 SO2H+ protonated sulfur dioxide so2h+  
945 C2H2O Oxirene oxirene  
946 CH2CO Ketene ch2co  
947 CH2CO+ Ketene cation ch2co+  
948 HCCOH ethynol hccoh  
949 CH2CS Thioketene ch2cs  
950 Be(OH)2 Beryllium hydroxide beo2h2  
951 Mg(OH)2 Magnesium dihydroxide h2mgo2  
952 NH2NO Nitrosamide nh2no  
953 CH2O2 Dioxirane diox  
954 H2COO Dioxymethyl radical h2coo  
955 H2COO+ dioxymethyl cation h2coo+  
956 HCOOH Formic acid ch2o2  
957 H2O3 Hydrogen trioxide h2o3  
958 HSSSH trisulfane hsssh  
959 NaOCH3 Sodium methoxide naoch3  
960 CH2BOH hydroxy(methylene)borane ch2boh  
961 CH3BO Borane, methyloxo- ch3bo  
962 CH2CHO Vinyloxy radical ch2cho  
963 CH2COH+ ketene, protonated ch2coh+  
964 CH3CO Acetyl radical ch3co  
965 CH3CO- Acetyl anion ch3co-  
966 CH3CO+ acetyl cation ch3co+  
967 CH2NOH formaldoxime ch2noh  
968 CH3NO nitrosomethane ch3no  
969 CHONH2 formamide formamide  
970 CNOH3 1,2-oxaziridine cnoh3  
971 HOCHNH hydroxymethylimine hochnh  
972 CHSNH2 thioformamide chsnh2  
973 NHCHSH Methanimidothioic acid nhchsh  
974 CH2OOH CH2OOH radical ch2ooh  
975 CH3OO methylperoxy radical ch3oo  
976 CH3OO- methylperoxy anion ch3oo-  
977 CH3OO+ methylperoxy cation ch3oo+  
978 C2H4O+ ethylene oxide cation c2h4o+  
979 CH2CHOH ethenol ch2choh  
980 CH3CHO Acetaldehyde ch3cho  
981 CH3CHO+ acetaldehyde cation ch3cho+  
982 H2COCH2+ Methyl, (methyleneoxoniumyl)- h2coch2+  
983 C2H4S Thiirane thiirane  
984 CH2CHSH Ethenethiol ch2chsh  
985 CH3CHS Thioacetaldehyde ch3chs  
986 H2CONH2+ protonated formamide h2conh2+  
987 NH2CHOH+ Formamide, O-protonated nh2choh+  
988 NH3CHO+ Formamide, N-Protonated nh3cho+  
989 CH2(OH)2 methanediol ch2o2h2  
990 CH3OOH Methyl peroxide ch3ooh  
991 CH3SSH Hydrogen methyl disulfide ch3ssh  
992 HSCH2SH Methanedithiol ch4s2  
993 H2OH2CO water formaldehyde dimer h2oh2co  
994 C2H4OH+ ethylene oxide, protonated c2h4oh+  
995 CH2CH2OH 2-hydroxy ethyl radical ch2ch2oh  
996 CH3CH2O Ethoxy radical ethoxy  
997 CH3CHOH 1-hydroxy-ethyl radical ch3choh  
998 CH3CHOH+ acetaldehyde, protonated ch3choh+  
999 CH3OCH2 methoxymethyl radical ch3och2  
1000 NH2CH2OH aminomethanol nh2ch2oh  
1001 CH3CH2OH Ethanol etoh  
1002 CH3OCH3 Dimethyl ether meome  
1003 CH3CH2SH ethanethiol etsh  
1004 CH3SCH3 Dimethyl sulfide mesme  
1005 CH3SCH3+ dimethyl sulfide cation mesme+  
1006 CH3SeCH3 dimethylselenide dmse  
1007 CH3OHH2O methanol water dimer ch3ohh2o  
1008 H2OCH3OH water methanol dimer h2och3oh  
1009 CuF2 Copper difluoride cuf2  
1010 ZnF2 Zinc difluoride znf2  
1011 CNF iso cyanogen fluoride cnf  
1012 FCN Cyanogen fluoride fcn  
1013 ClCN chlorocyanogen clcn  
1014 BrCN Cyanogen bromide brcn  
1015 ICN Cyanogen iodide icn  
1016 FBO Boron monofluoride monoxide fbo  
1017 BeF2 Beryllium fluoride bef2  
1018 MgF2 Magnesium fluoride mgf2  
1019 BeCl2 Beryllium chloride becl2  
1020 MgCl2 Magnesium dichloride mgcl2  
1021 CaCl2 Calcium Chloride cacl2  
1022 ZnCl2 Zinc dichloride zncl2  
1023 BeBr2 Beryllium bromide bebr2  
1024 CaBr2 Calcium dibromide cabr2  
1025 CaF2 Calcium difluoride caf2  
1026 FCO Carbonyl fluoride fco  
1027 FCO+ Carbonyl fluoride cation fco+  
1028 ClCO carbonyl monochloride clco  
1029 BF2 Boron difluoride radical bf2  
1030 ClNO Nitrosyl chloride clno  
1031 OPCl Phosphorus oxychloride opcl  
1032 BrNO Nitrosyl bromide brno  
1033 INO Nitrosyl iodide ino  
1034 CF2- Difluoromethylene anion cf2-  
1035 CF2+ Difluoromethylene cation cf2+  
1036 CFCl chlorofluoromethylene cfcl  
1037 SiF2 Silicon difluoride sif2  
1038 SiF2+ Silicon difluoride cation sif2+  
1039 CCl2 dichloromethylene ccl2  
1040 CCl2- dichloromethylene anion ccl2-  
1041 CCl2+ dichloromethylene cation ccl2+  
1042 SiCl2 Dichlorosilylene sicl2  
1043 GeF2 Germanium difluoride gef2  
1044 GeCl2 Germanium dichloride gecl2  
1045 CBr2 dibromomethylene cbr2  
1046 FOO Dioxygen monofluoride radical foo  
1047 FOO+ Fluorine dioxide cation foo+  
1048 ClOO chloroperoxy radical cloo  
1049 ClOO+ chloroperoxy cation cloo+  
1050 OClO- Chlorine dioxide anion oclo-  
1051 OClO+ Chlorine dioxide cation oclo+  
1052 ClS2 Sulfur chloride cls2  
1053 BrOO Bromine dioxide broo  
1054 OBrO Bromine dioxide radical obro  
1055 NF2 Difluoroamino radical nf2  
1056 NF2+ Difluoroamino cation nf2+  
1057 PF2 Phosphorus difluoride pf2  
1058 PF2+ Phosphorus difluoride cation pf2+  
1059 F2O Difluorine monoxide f2o  
1060 SF2 sulfur difluoride sf2  
1061 SF2- sulfur difluoride anion sf2-  
1062 SF2+ sulfur difluoride cation sf2+  
1063 Cl2O Dichlorine monoxide cl2o  
1064 SCl2 Sulfur dichloride scl2  
1065 SeF2 Selenium difluoride sef2  
1066 BrOCl Bromine hypochlorite brocl  
1067 SeCl2 Selenium Dichloride secl2  
1068 SBr2 Sulfur dibromide sbr2  
1069 SeBr2 Selenium dibromide sebr2  
1070 BrOBr Bromine oxide brobr  
1071 F3- trifluoride anion f3-  
1072 Cl3- trichloride anion cl3-  
1073 Br3- tribromide anion br3-  
1074 I3- triiodide i3-  
1075 SFCl Sulfur chloride fluoride sfcl  
1076 HCCF Fluoroacetylene hccf  
1077 HCCF+ fluoroacetylene cation hccf+  
1078 HCCCl Chloroacetylene hcccl  
1079 HCCBr bromoacetylene hccbr  
1080 HFCO formyl fluoride hfco  
1081 HFCO+ formyl fluoride cation hfco+  
1082 COHCl Formyl chloride cohcl  
1083 COHBr Formyl bromide cohbr  
1084 BHF2 Difluoroborane bhf2  
1085 BHCl2 Borane, dichloro- bhcl2  
1086 CHCl2 dichloromethyl radical chcl2  
1087 CHF2 difluoromethyl radical chf2  
1088 CHF2+ difluoromethyl cation chf2+  
1089 CHFCl Chlorofluoromethyl radical chfcl  
1090 CHFCl+ Chlorofluoromethyl cation chfcl+  
1091 CHCl2+ dichloromethyl cation chcl2+  
1092 CHBr2 dibromomethyl radical chbr2  
1093 HOClO Chlorous acid hoclo  
1094 NHF2 difluoramine nhf2  
1095 NHCl2 dichloroamine nhcl2  
1096 CH2F2 Methane, difluoro- ch2f2  
1097 CH2FCl fluorochloromethane ch2fcl  
1098 SiH2F2 difluorosilane sih2f2  
1099 CH2Cl2 Methylene chloride ch2cl2  
1100 CH2BrF Methane, bromofluoro- ch2fbr  
1101 CH2BrCl Methane, bromochloro- ch2clbr  
1102 CH2FI fluoroiodomethane ch2fi  
1103 CH2Br2 dibromomethane ch2br2  
1104 CH2ClI chloroiodomethane ch2cli  
1105 CH2BrI bromoiodomethane ch2bri  
1106 CH2I2 Diiodomethane ch2i2  
1107 SiH2Cl2 dichlorosilane sih2cl2  
1108 CH3MgBr Methyl Magnesium Bromide ch3mgbr  
1109 CH2CHF Ethene, fluoro- ch2chf  
1110 CH2CHF+ fluoroethene cation ch2chf+  
1111 C2H3Cl Ethene, chloro- ch2chcl  
1112 C2H3Br vinyl bromide c2h3br  
1113 C2H3I Vinyl iodide c2h3i  
1114 CH2FOH fluoromethanol ch2foh  
1115 CH3OCl methyl hypochlorite ch3ocl  
1116 CH2CH2Cl 2-chloroethyl radical ch2ch2cl  
1117 CHClCH3 1-chloroethyl radical chclch3  
1118 C2H5F fluoroethane c2h5f  
1119 CH3CH2Cl Ethyl chloride c2h5cl  
1120 CH3SiFH2 fluoromethylsilane ch3sifh2  
1121 C2H5Br Ethyl bromide etbr  
1122 C2H5I Ethyl iodide c2h5i  
1123 KrF2 Krypton difluoride krf2  
1124 XeF2 Xenon difluoride xef2  
1125 B4H10 Tetraborane(10) b4h10  
1126 C4 Carbon tetramer c4  
1127 C4+ Carbon tetramer cation c4+  
1128 C4H2 Diacetylene c4h2  
1129 C4H2+ diacetlyene cation c4h2+  
1130 C2H3CCH 1-Buten-3-yne c2h3cch  
1131 C4H4 cyclobutadiene cbd  
1132 C4H4 Tetrahedrane c4h4  
1133 H2CCCCH2 Butatriene h2cccch2  
1134 C4H6 1-Methylcyclopropene c3100047  
1135 C4H6 Cyclobutene c822355  
1136 C4H6 Methylenecyclopropane c6142730  
1137 CH2CCHCH3 1,2-Butadiene butad12  
1138 CH2CHCHCH2 1,3-Butadiene c106990  
1139 CH3CCCH3 2-Butyne c503173  
1140 CHCCH2CH3 1-Butyne c107006  
1141 CH3CHCHCH2 methylallyl radical c4h7  
1142 C4H8 methylcyclopropane mcp  
1143 CH2C(CH3)CH3 1-Propene, 2-methyl- isobute  
1144 CH2CHCH2CH3 1-Butene bute1  
1145 CH3CHCHCH3 2-Butene, (E)- bute2e  
1146 CH3CHCHCH3 2-Butene, (Z)- bute2z  
1147 B(CH3)3 trimethylborane bme3  
1148 Al(CH3)3 trimethyl aluminum tma  
1149 C(CH3)3 Tert-butyl radical tbutyl  
1150 CH2CH(CH3)2 Isobutyl radical isobutyl  
1151 CH3CHCH2CH3 2-Butyl radical butyl2  
1152 CH3CH(CH3)CH3 Isobutane isobutane  
1153 CH3CH2CH2CH3 Butane butane  
1154 SiH(CH3)3 trimethylsilane trimsi  
1155 Li3N trilithium nitride li3n  
1156 C2N2 Cyanogen c2n2  
1157 C2N2+ Cyanogen cation c2n2+  
1158 P4 Phosphorus tetramer p4  
1159 As4 Arsenic tetramer as4  
1160 HCCCN Cyanoacetylene hcccn  
1161 HCCCN+ Cyanoacetylene cation hcccn+  
1162 H2CNCN cyanamide, methylene ch2ncn  
1163 HNCCNH Ethenediimine hnccnh  
1164 C3H3N acrylonitrile ch2chcn  
1165 C3H3N+ acrylonitrile cation ch2chcn+  
1166 CH3N3 methyl azide ch3n3  
1167 NH2CCNH2 Diaminoacetylene daa  
1168 NH2CH2CN Aminoacetonitrile aan  
1169 CH3NHN2+ methyl azide, protonated ch3nhn2+  
1170 C2H5CN ethyl cyanide c2h5cn  
1171 CH5N3 Guanidine guanidine  
1172 C4H6 Bicyclo[1.1.0]butane c157335  
1173 CH3NNCH3 (Z)-1,2-Dimethyldiazene dmdiazz  
1174 H2NCHCHNH2 diaminoethylene dae  
1175 CH6N3+ guanidinium ch6n3+  
1176 C3H7N Cyclopropylamine cpram  
1177 CH7N3 triaminomethane tam  
1178 C3H7N Azetidine azet  
1179 C4H8 cyclobutane cbutane  
1180 C2H8N2 Ethylenediamine ethdiam  
1181 CH3NHNHCH3 dimethyl hydrazine dmh  
1182 CH3CH(NH2)CH3 2-Propanamine pram2  
1183 N(CH3)3 Trimethylamine trimeam  
1184 NH2CH2CH2CH3 1-Propanamine pram1  
1185 P(CH3)3 trimethylphosphine tmp  
1186 N(SiH3)3 trisilylamine tsa  
1187 As(CH3)3 trimethyl arsine tmas  
1188 (CH3)3NH+ protonated trimethyl amine ptma  
1189 C3H7NH3+ n-propylamine, protonated c3h7nh2  
1190 Li2O2 dilithium dioxide li2o2  
1191 Na2O2 disodium dioxide na2o2  
1192 K2O2 dipotassium dioxide k2o2  
1193 C3O Tricarbon monoxide c3o  
1194 B2O2 Diboron dioxide b2o2  
1195 ONNO NO dimer onno  
1196 CO3 Carbon trioxide co3  
1197 CO3-- carbonate co3--  
1198 CS3-- Carbonotrithioate cs3--  
1199 NO3 Nitrogen trioxide no3  
1200 NO3- nitrate anion no3-  
1201 NO3+ nitrogen trioxide cation no3+  
1202 SO3 Sulfur trioxide so3  
1203 SO3- Sulfur trioxide anion so3-  
1204 SO3-- Sulfate dianion so3--  
1205 SO3+ Sulfur trioxide cation so3+  
1206 SeO3 selenium trioxide seo3  
1207 S4 Sulfur tetramer s4  
1208 TeO3 Tellurium trioxide teo3  
1209 HCO3- bicarbonate anion hco3-  
1210 HNO3 Nitric acid hno3  
1211 HSO3 Hydroxysulfonyl radical hso3  
1212 NH2NO2 nitramide nh2no2  
1213 C2H2CO cyclopropenone c2h2co  
1214 C3H2O Propadienal c3h2o  
1215 HCCCHO 2-propynal hcccho  
1216 C2H2O2 Ethanedial c2h2o2  
1217 C2H2O2+ Ethanedial cation c2h2o2+  
1218 H2CO3 Carbonic acid h2co3  
1219 H2CS3 thiocarbonic acid h2cs3  
1220 H2NO3+ Nitric Acid, Protonated h2no3+  
1221 H2SO3 Sulfurous acid h2so3  
1222 C2H3NO Nitrosoethylene c2h3no  
1223 CH3NCO methylisocyante ch3nco  
1224 HOCH2CN cyanomethanol hoch2cn  
1225 CH3COO- acetate anion ch3coo-  
1226 CH3NO2 Methane, nitro- ch3no2  
1227 CH3ONO Methyl nitrite ch3ono  
1228 NH2COOH Carbamic acid nh2cooh  
1229 H3BO3 Boric acid h3bo3  
1230 H3AlO3 Aluminum hydroxide h3alo3  
1231 H3CO3+ carbonic acid, protonated h3co3+  
1232 C3H4O 2-Propyn-1-ol c107197  
1233 C3H4O allenol c9000071  
1234 C3H4O Cyclopropanone cpone  
1235 C3H4O Methylketene c6004440  
1236 CH2CHCHO Acrolein c3h4o  
1237 NH2CONH2 Urea urea  
1238 NH2CONH2+ Urea cation urea+  
1239 NH2CSNH2 Thiourea thiourea  
1240 C2H4O2 1,3-dioxetane c2h4o2  
1241 CH3COOH Acetic acid ch3cooh  
1242 CH3OCHO methyl formate ch3ocho  
1243 CHOCH2OH hydroxy acetaldehyde haa  
1244 NH2COOH2+ Carbamic acid, O-protonated nh2cooh2+  
1245 NH3COOH+ protonated Carbamic acid nh3cooh+  
1246 H2OHCOOH Water formic acid dimer 1 h2ohcooh_10  
1247 H2OHCOOH Water formic acid dimer 2 h2ohcooh_11  
1248 HCOOHH2O Formic acid water dimer hcoohh2o  
1249 HOCH2OOH hydroxy methyl peroxide hoch2ooh  
1250 CH3COCH2 Acetonyl radical ch3coch2  
1251 CH2C(OH)NH2 1-amino vinyl alchohol ava  
1252 CH3C(OH)=NH Ethaninidic acid eia  
1253 CH3CHNOH Acetaldoxime acetaldoxime  
1254 CH3CONH2 Acetamide acetamide  
1255 HCONHCH3 N-methylformamide nmfa  
1256 CH3CSNH2 Ethanethioamide ch3csnh2  
1257 CH5N2O+ urea, N-protonated ch4n2o+  
1258 H2NCOHNH2+ urea, protonated ureah+  
1259 C2H5OO ethylperoxy radical c2h5oo  
1260 CH3NNCH3 (E)-1,2-Dimethyldiazene dmdiaze  
1261 C3H5OH Cyclopropanol cproh  
1262 C3H6O 2-Propen-1-ol c107186  
1263 C3H6O Acetone enol enol  
1264 C3H6O Oxetane oxetane  
1265 C3H6O Propylene oxide prox  
1266 CH3CH2CHO Propanal propanal  
1267 CH3COCH3 Acetone acetone  
1268 CH3COCH3- acetone anion ch3coch3-  
1269 C3H6S Thietane thietane  
1270 C3H6S Thiirane, methyl- methiirane  
1271 CH3CSCH3 Thioacetone ch3csch3  
1272 C2H6O2 1,2-Ethanediol ethdiol  
1273 CH3OOCH3 dimethylperoxide dmp  
1274 CH3SOCH3 Dimethyl sulfoxide dmso  
1275 CH2SHCH2SH 1,2-Ethanedithiol ethdisl  
1276 CH3SSCH3 Disulfide, dimethyl ch3ssch3  
1277 CH3COHCH3+ acetone, protonated acetoneh+  
1278 HOCH2CH2NH2 monoethanolamine mea  
1279 C3H7OH 1-Propanol proh  
1280 CH3CHOHCH3 Isopropyl alcohol isoproh  
1281 CH3OC2H5 Ethane, methoxy- etome  
1282 C3H7SH 1-Propanethiol prsh  
1283 CH3CHSHCH3 2-Propanethiol isoprsh  
1284 CH3SCH2CH3 Ethane, (methylthio)- etsme  
1285 H2OCH3OCH3 water dimethylether dimer h2och3och3  
1286 Li2F2 Lithium fluoride dimer li2f2  
1287 Na2F2 Sodium Fluoride Dimer na2f2  
1288 Na2Cl2 Disodium dichloride na2cl2  
1289 C2F2 difluoroacetylene c2f2  
1290 C2Cl2 dichloroacetylene c2cl2  
1291 C2Cl2+ dichloroacetylene cation c2cl2+  
1292 FNO2 Nitryl fluoride fno2  
1293 FONO Nitrosyl hypofluorite fono  
1294 ClNO2 Nitryl chloride clno2  
1295 ClONO chlorine nitrite clono  
1296 BrONO Bromine nitrite brono  
1297 N2F2 (Z)-Difluorodiazene n2f2_z  
1298 N2F2 Dinitrogen difluoride, (E)- n2f2_e  
1299 CF2O Carbonic difluoride f2co  
1300 CF2O+ Carbonic difluoride cation f2co+  
1301 COFCl Carbonic chloride fluoride cofcl  
1302 CCl2O Phosgene cl2co  
1303 Cl2CS Thiophosgene cl2cs  
1304 COBr2 Carbonic dibromide cobr2  
1305 BF3- Borane, trifluoro- anion bf3-  
1306 BF3+ boron trifluoride cation bf3+  
1307 BClF2 Chlorodifluoroborane bclf2  
1308 AlF2Cl Aluminum chloride difluoride alclf2  
1309 ScF3 Scandium trifluoride ScF3  
1310 AlFCl2 Aluminum dichloride fluoride alcl2f  
1311 BCl3 Borane, trichloro- bcl3  
1312 BCl3+ Boron Trichloride cation bcl3+  
1313 GaF3 Gallium trifluoride gaf3  
1314 AlCl3 Aluminum trichloride alcl3  
1315 GaCl3 Gallium trichloride gacl3  
1316 BBr3 Boron tribromide bbr3  
1317 AlBr3 Aluminum Bromide albr3  
1318 ClO3 Chlorine trioxide clo3  
1319 ClO3- chlorate anion clo3-  
1320 BrO3- Bromate anion bro3-  
1321 CF3 Trifluoromethyl radical cf3  
1322 CF3- Trifluoromethyl anion cf3-  
1323 CF3+ Trifluoromethyl cation cf3+  
1324 CF2Cl difluorochloromethyl radical cf2cl  
1325 SiF3 Silicon trifluoride radical sif3  
1326 SiF3+ Silicon trifluoride cation sif3+  
1327 CFCl2 dichlorofluoromethyl radical cfcl2  
1328 CCl3 Trichloromethyl radical ccl3  
1329 CCl3- Trichloromethyl anion ccl3-  
1330 CCl3+ Trichloromethyl cation ccl3+  
1331 SiCl3 trichlorosilyl radical sicl3  
1332 SiCl3+ trichlorosilyl cation sicl3+  
1333 CBr3 tribromomethyl radical cbr3  
1334 FOOF Perfluoroperoxide foof  
1335 F2SO Thionyl Fluoride f2so  
1336 ClOOCl Dichlorine dioxide cloocl  
1337 FSSF Difluorodisulfane fssf  
1338 S2F2 Thio-thionyl fluoride s2f2  
1339 SOCl2 thionyl chloride socl2  
1340 SSCl2 Thiothionyl chloride sscl2  
1341 SeOCl2 selenium oxychloride seocl2  
1342 NF3 Nitrogen trifluoride nf3  
1343 NF3- Nitrogen trifluoride anion nf3-  
1344 NF3+ Nitrogen trifluoride cation nf3+  
1345 PF3 Phosphorus trifluoride pf3  
1346 NCl3 nitrogen trichloride ncl3  
1347 AsF3 Arsenic trifluoride asf3  
1348 PCl3 Phosphorus trichloride pcl3  
1349 SbF3 Antimony Trifluoride sbf3  
1350 AsCl3 Arsenous trichloride ascl3  
1351 SbCl3 Antimony Trichloride sbcl3  
1352 NBr3 Nitrogen Tribromide nbr3  
1353 PBr3 Phosphorus tribromide pbr3  
1354 AsBr3 Arsenic tribromide asbr3  
1355 NI3 Nitrogen triiodide ni3  
1356 PI3 Phosphorus triiodide pi3  
1357 ClSSCl Disulfur dichloride s2cl2  
1358 SF3 Sulfur trifluoride sf3  
1359 ClF3 Chlorine trifluoride clf3  
1360 BrF3 Bromine trifluoride brf3  
1361 IF3 iodone trifluoride if3  
1362 HClO3 Chloric Acid hclo3  
1363 CHF3 Methane, trifluoro- chf3  
1364 CHF2Cl difluorochloromethane chf2cl  
1365 SiHF3 trifluorosilane sihf3  
1366 CHFCl2 fluorodichloromethane chfcl2  
1367 CDCl3 trichloromethane-d cdcl3  
1368 CHCl3 Chloroform chcl3  
1369 CHBrF2 Methane, bromodifluoro- chbrf2  
1370 SiHCl3 Trichlorosilane sihcl3  
1371 CHFClBr fluorochlorobromomethane chfclbr  
1372 CHBrCl2 Methane, bromodichloro- chbrcl2  
1373 CHF2I difluoroiodomethane chf2i  
1374 CHBr2F dibromofluoromethane chbr2f  
1375 CHFClI fluorochloroiodomethane chfcli  
1376 CHCl2I dichloroiodomethane chcl2i  
1377 CHClBr2 Methane, dibromochloro- chclbr2  
1378 CHBr3 bromoform chbr3  
1379 CHI3 Iodoform chi3  
1380 NF3H+ protonated nitrogen trifluoride nf3h+  
1381 AsF3H+ Arsenic trifluoride, protonated asf3h+  
1382 C2H2F2 Ethene, 1,2-difluoro-, (E)- c2h2f2e  
1383 C2H2F2 Ethene, 1,2-difluoro-, (Z)- c2h2f2z  
1384 CH2CF2 Ethene, 1,1-difluoro- ch2cf2  
1385 C2H2ClF 1-chloro-1-fluoroethylene c2h2clf  
1386 CHFCHCl (E)-1-chloro-2-fluoroethene chfchcle  
1387 CHFCHClz (Z)-1-Chloro-2-fluoroethene chfchclz  
1388 CH2CCl2 Ethene, 1,1-dichloro- ch2ccl2  
1389 CHClCHCl Ethene, 1,2-dichloro-, (E)- chclchcle  
1390 CHClCHCl Ethene, 1,2-dichloro-, (Z)- chclchclz  
1391 C2H2Br2 1,1-dibromoethene c2h2br2  
1392 CHBrCHBr Ethene, 1,2-dibromo-, (E)- chbrchbre  
1393 CHBrCHBr Ethene, 1,2-dibromo-, (Z)- chbrchbrz  
1394 CH2FCHO Fluoroacetaldehyde ch2fcho  
1395 CH3COF Acetyl fluoride ch3cof  
1396 CH2ClCHO chloroacetaldehyde ch2clcho  
1397 CH3COCl Acetyl Chloride ch3cocl  
1398 C2H4F2 1,2-difluoroethane c2h4f2  
1399 CH3CHF2 Ethane, 1,1-difluoro- ch3chf2  
1400 CH2FCH2Cl Ethane, 1-chloro-2-fluoro- ch2fch2cl  
1401 CH3CHFCl Ethane, 1-chloro-1-fluoro- ch3chfcl  
1402 CH2ClCH2Cl Ethane, 1,2-dichloro- ch2clch2cl  
1403 CH3CHCl2 Ethane, 1,1-dichloro- ch3chcl2  
1404 CH2BrCH2Cl 1-bromo-2-chloroethane ch2brch2cl  
1405 CH2BrCH2Br Ethane, 1,2-dibromo- ch2brch2br  
1406 CH2CFCH3 2-fluoropropene 2fpro  
1407 CH2CHCH2F Allyl Fluoride allylf  
1408 CH3CHCHF trans-1-Fluoro-1-propene propene1ft  
1409 C3H5Cl 1-Propene, 3-chloro- prop1cl3  
1410 C3H5Cl 1-chloro-1-propene(E) prop1cl1e  
1411 C3H5Cl 1-chloro-1-propene(Z) prop1cl1z  
1412 CH2FCH2OH 2-fluoroethanol ch2fch2oh  
1413 CH2ClCH2OH 2-Chloroethanol ch2clch2oh  
1414 CH2ClCH2OH2+ 2-chloroethanol, protonated ch2clch2oh2+  
1415 CH2FCH2CH3 1-Fluoropropane prf1  
1416 CH3CHFCH3 2-Fluoropropane prf2  
1417 CH2ClCH2CH3 Propane, 1-chloro- prcl1  
1418 CH3CHClCH3 Propane, 2-chloro- prcl2  
1419 CH3CH2CH2Br n-propyl bromide prbr  
1420 CH3CHBrCH3 i-propyl bromide iprbr  
1421 C3H9O+ trimethyl oxonium cation c3h9o+  
1422 B5H9 pentaborane9 b5h9  
1423 C5H4 pentatetraene ptrene  
1424 C5H5 cyclopentadienyl radical c5h5  
1425 C5H5- cylopentadienyl anion c5h5-  
1426 C5H6 1,3-Cyclopentadiene c542927  
1427 C5H6 1-Buten-3-yne, 2-methyl- c78808  
1428 C5H6 3-Penten-1-yne, (E)- c2004695  
1429 C5H6 3-Penten-1-yne, (Z)- c1574409  
1430 C5H6 Bicyclo[2.1.0]pent-2-ene c5164352  
1431 C5H6 Cyclopropylacetylene c6746947  
1432 C5H6 Propellane propellane  
1433 C5H7 1,3-pentadienyl radical pdyl  
1434 C5H7 cyclopentenyl radical cpyl  
1435 C5H8 1,2-Butadiene, 3-methyl- c598254  
1436 C5H8 1,2-Pentadiene c591957  
1437 C5H8 1,3-Butadiene, 2-methyl- c78795  
1438 C5H8 1,3-Pentadiene, (E)- c2004708  
1439 C5H8 1,3-Pentadiene, (Z)- c1574410  
1440 C5H8 1,4-Pentadiene c591935  
1441 C5H8 1-pentyne a1pentyne  
1442 C5H8 2,3-Pentadiene c591968  
1443 C5H8 Bicyclo[1.1.1]pentane bcp  
1444 C5H8 Cyclobutane, methylene- c1120565  
1445 C5H8 Cyclopentene c142290  
1446 C5H8 Ethenylcyclopropane c693867  
1447 CH3CCCH2CH3 2-Pentyne 2pentyne  
1448 C5H10 1-Butene, 2-methyl- c563462  
1449 C5H10 2-Butene, 2-methyl- c513359  
1450 C5H10 2-Pentene, (E)- c646048  
1451 C5H10 2-Pentene, (Z)- c627203  
1452 C5H10 Cyclopentane c287923  
1453 C5H10 Cyclopropane, 1,1-dimethyl- c1630940  
1454 CH2CHCH2CH2CH3 1-pentene pentene  
1455 C5H11 2-Methylbut-2-yl radical c4348350  
1456 C5H12 Butane, 2-methyl- buta2  
1457 C5H12 Pentane pentane  
1458 C5H12 Propane, 2,2-dimethyl- neopentane  
1459 Si(CH3)4 tetramethylsilane tms  
1460 N2O3 Dinitrogen trioxide n2o3  
1461 C3H2N2 Malononitrile c3h2n2  
1462 CH2N4 1H-Tetrazole 1htz  
1463 C3H3N2 imidazolyl radical im  
1464 C3H3N2- imidizolyl anion im-  
1465 C2H3N3 1H-1,2,4-Triazole c288880  
1466 C4H4N pyrrolide radical c4h4n  
1467 C4H4N- pyrrolide anion c4h4n-  
1468 C3H4N2 1H-Imidazole 1himidaz  
1469 C3H4N2 1H-Pyrazole 1hpyraz  
1470 C3H4N2 2H-Imidazole imid2h  
1471 C3H4N2 4H-Imidazole imid4h  
1472 C4H5N (E)-2-Butenenitrile c627269  
1473 C4H5N (Z)-2-Butenenitrile c1190767  
1474 C4H5N 2H-pyrrole pyrrole2  
1475 C4H5N 3H-pyrrole pyrrole3  
1476 C4H5N Cyclopropanecarbonitrile c5500210  
1477 C4H5N Pyrrole pyrrole  
1478 CH2CHCH2CN Allylcyanide ch2chch2cn  
1479 C4H6N+ pyrrole, alpha-protonated appyr  
1480 C4H6N+ pyrrole, beta-protonated bppyr  
1481 C4H6N+ pyrrole, protonated ppyr  
1482 C3H6N2 3-Aminopropionitrile c151188  
1483 CH3CH(CH3)CN Propanenitrile, 2-methyl- c4h7n  
1484 CH3CH2CH2CN Butanenitrile c109740  
1485 C5H8 Bicyclo[2.1.0]pentane c185944  
1486 C5H8 Spiropentane c157404  
1487 C4H9N Cyclobutylamine cbam  
1488 C4H9N Pyrrolidine pyrrolidine  
1489 C3H10N2 1,2-Diaminopropane diampr12  
1490 C(CH3)3NH2 2-Propanamine, 2-methyl- c75649  
1491 C(NH2)H2C(CH3)HCH3 1-Propanamine, 2-methyl- c78819  
1492 C(NH2)H2CH2CH2CH3 1-Butanamine butam1  
1493 CH3C(NH2)HCH2CH3 2-Butanamine butam2  
1494 NH(C2H5)2 diethylamine dea  
1495 NC4H12+ tetramethyl ammonium cation nc4h12+  
1496 C3O2 Carbon suboxide c3o2  
1497 C3O2+ Carbon suboxide cation c3o2+  
1498 B2O3 diboron trioxide b2o3  
1499 MgCO3 Magnesium Carbonate mgco3  
1500 BeCO3 Beryllium Carbonate beco3  
1501 CaCO3 Calcium Carbonate caco3  
1502 ONONO Nitrosyl nitrite onono  
1503 PO4--- phosphate po4---  
1504 SO4-- sulfate so4--  
1505 HOONO2 peroxy nitric acid hoono2  
1506 HSO4- bisulfate anion hso4-  
1507 C2H2N2S 1,3,4-Thiadiazole c2h2n2s  
1508 C3H2O2 Propiolic acid c3h2o2  
1509 CHOCOOH oxo acetic acid oaa  
1510 CHOOCHO diformyl ether choocho  
1511 H2SO4 Sulfuric acid h2so4  
1512 H2SeO4 Selenic acid h2seo4  
1513 C3H3NO Isoxazole isox  
1514 C3H3NO Oxazole oxazole  
1515 C3H3NS Thiazole thiazole  
1516 CH3C(O)OO acetyl peroxy radical ch3coo2  
1517 CH3NO3 Methyl nitrate ch3no3  
1518 H3PO4 Phosphoric Acid h3po4  
1519 C4H4O Furan furan  
1520 C4H4O+ Furan cation furan+  
1521 CH3COCCH 3-butyn-2-one c1423605  
1522 C4H4S Thiophene furans  
1523 C4H4Se selenophene c4h4se  
1524 C3H4O2 β–Propiolactone beta  
1525 C3H4O2 2-Propenoic acid propenoic2  
1526 C3H4O2 Methyl glyoxal megly  
1527 C3H4O2 propanedial propanedial  
1528 C3H4O2 propenalol propenalol  
1529 HOCHCCHOH allenediol aldiol  
1530 C2H4O3 1,2,3-trioxolane c2h4o3  
1531 C2H4O3 trioxolane124 triox  
1532 HOCH2COOH Hydroxyacetic acid hac  
1533 CH2CHCONH2 Acrylamide c79061  
1534 CH3OCH2CN Methoxyacetonitrile c1738369  
1535 CH5N3S Hydrazinecarbothioamide c79196  
1536 H2NCH2COOH Glycine glycine  
1537 CH3SO2NH2 methanesulfonamide ch3so2nh2  
1538 C4H6O cis-2-butenal butenal2c  
1539 C4H6O Cyclobutanone cbutone  
1540 C4H6O Furan, 2,3-dihydro- furan23h  
1541 C4H6O Furan, 2,5-dihydro- furan25h  
1542 CH2CHOCHCH2 Vinyl ether vinylether  
1543 CHOCHCHCH3 2-Butenal butenal2  
1544 C4H6S Thiophene, 2,3-dihydro- thiop23h  
1545 C4H6S Thiophene, 2,5-dihydro- thiop25h  
1546 CH2CHSCHCH2 Divinyl sulfide divis  
1547 C2H6N2O Urea, methyl- c598505  
1548 C3H6O2 1,3-Dioxolane dioxolane  
1549 CH3CH2COOH Propanoic Acid propanoic  
1550 CH3COOCH3 methyl acetate aame  
1551 HCOOC2H5 Ethyl formate faee  
1552 C2H6O2S Dimethyl sulfone c67710  
1553 CH3SSSCH3 dimethyl trisulfide c2h6s3  
1554 C3H7NO dimethylformamide dmf  
1555 C3H7NO Propanamide propanam  
1556 C2H3OC2H5 Ethene, ethoxy- c109922  
1557 C4H8O Cyclobutanol c2919235  
1558 C4H8O Furan, tetrahydro- thf  
1559 CH2C(CH3)OCH3 1-Propene, 2-methoxy- pre1meo2  
1560 CH3COCH2CH3 2-Butanone buta2one  
1561 CHOCH(CH3)CH3 Propanal, 2-methyl- c78842  
1562 CHOCH2CH2CH3 Butanal butanal  
1563 C4H8S Thiophene, tetrahydro- tht  
1564 C3H8O2 1,3-Propanediol c504632  
1565 C3H8O2 Hydroperoxide, 1-methylethyl c3031752  
1566 C3H8O2 Methane, dimethoxy- c109875  
1567 C3H8O2 Propylene glycol c57556  
1568 C3H8S2 1,3-Propanedithiol c109808  
1569 C4H10O 1-Butanol butanol1  
1570 C4H10O 1-Propanol, 2-methyl- c78831  
1571 C4H10O 2-Butanol, (.+/-.)- butanol2  
1572 C4H10O Ethanol, 1,1-dimethyl- tbuoh  
1573 C4H10O Ethoxy ethane etoet  
1574 C4H10O Methyl propyl ether meopr  
1575 C4H10O Propane, 2-methoxy- c598538  
1576 C4H10O+ 1-Butanol cation butanol1+  
1577 C(CH3)3SH 2-Propanethiol, 2-methyl- tbush  
1578 C2H5SC2H5 Diethyl sulfide etset  
1579 C4H9SH 1-Butanethiol bush  
1580 CH2(SH)CH(CH3)CH3 1-Propanethiol, 2-methyl- c513440  
1581 CH3C(SCH3)HCH3 Propane, 2-(methylthio)- mesipr  
1582 CH3CH(SH)CH2CH3 2-Butanethiol butansl2  
1583 FNO3 Fluorine nitrate fno3  
1584 ClONO2 Chlorine nitrate clono2  
1585 BrONO2 Bromine nitrate brono2  
1586 TiCl4 Titanium tetrachloride ticl4  
1587 ClO4- perchlorate anion clo4-  
1588 BF4- tetrafluoroboron anion bf4-  
1589 ClFO3 Perchloryl fluoride clfo3  
1590 SO2F2 Sulfuryl fluoride so2f2  
1591 SO2Cl2 Sulfuryl chloride so2cl2  
1592 F3NO Nitrogen trifluoride oxide f3no  
1593 F3PO Phosphoryl fluoride pf3o  
1594 Cl3PO Phosphoryl chloride pcl3o  
1595 CF4 Carbon tetrafluoride cf4  
1596 CF3Cl Methane, chlorotrifluoro- cf3cl  
1597 SiF4 Silicon tetrafluoride sif4  
1598 CF2Cl2 difluorodichloromethane cf2cl2  
1599 TiF4 Titanium tetrafluoride tif4  
1600 CFCl3 Trichloromonofluoromethane cfcl3  
1601 CF3Br Bromotrifluoromethane cf3br  
1602 GeF4 Germanium tetrafluoride gef4  
1603 CCl4 Carbon tetrachloride ccl4  
1604 CCl4+ Carbon tetrachloride cation ccl4+  
1605 CBrClF2 Methane, bromochlorodifluoro- cbrclf2  
1606 SiCl4 Silane, tetrachloro- sicl4  
1607 CBrCl2F bromodichlorofluoromethane cbrcl2f  
1608 CF3I trifluoroiodomethane cf3i  
1609 CBrCl3 Methane, bromotrichloro- cbrcl3  
1610 CBr2F2 Methane, dibromodifluoro- cbr2f2  
1611 GeCl4 Germanium Tetrachloride gecl4  
1612 CBr2ClF dibromochlorofluoromethane cbr2clf  
1613 CBr2Cl2 dibromodichloromethane cbr2cl2  
1614 CCl3I trichloroiodomethane ccl3i  
1615 CFBr3 fluorotribromomethane cfbr3  
1616 CFClBrI fluorochlorobromoiodomethane cfclbri  
1617 CBr3Cl tribromochloromethane cbr3cl  
1618 CF2I2 difluorodiiodomethane cf2i2  
1619 CBr4 Carbon tetrabromide cbr4  
1620 CCl2I2 dichlorodiiodomethane ccl2i2  
1621 SiBr4 Silicon tetrabromide sibr4  
1622 CBr3I tribromoiododmethane cbr3i  
1623 GeBr4 Germanium tetrabromide gebr4  
1624 CI4 tetraiodomethane ci4  
1625 SiI4 silicon tetraiodide sii4  
1626 ClOF3 Chlorine trifluoride oxide clof3  
1627 SF4 Sulfur tetrafluoride sf4  
1628 SeF4 Selenium tetrafluoride sef4  
1629 SCl4 Sulfur tetrachloride scl4  
1630 C2HF3 Trifluoroethylene c2hf3  
1631 C2HF3+ Trifluoroethylene cation c2hf3+  
1632 CHClCCl2 Trichloroethylene chclccl2  
1633 CHBrCF2 1-Bromo-2,2-difluoroethylene chbrcf2  
1634 HSO3F Fluorosulfonic acid hso3f  
1635 CF3OH trifluoromethanol cf3oh  
1636 CH2ClCCCl 1,3-dichloropropyne ch2clcccl  
1637 CHClCCHCl 1,3-dichloroallene chclcchcl  
1638 CHCl2CCH 3,3-dichloropropyne chcl2cch  
1639 CHCl2CHO dichloroacetaldehyde chcl2cho  
1640 PF3CH2 phosphorane, trifluoromethylene- pf3ch2  
1641 CH3CF3 Ethane, 1,1,1-trifluoro- ch3cf3  
1642 CHF2CH2F Ethane, 1,1,2-trifluoro ch2fchf2  
1643 CH3CF2Cl 1-Chloro-1,1-Difluoroethane ch3cf2cl  
1644 CH3CFCl2 1,1-Dichloro-1-fluoroethane ch3cfcl2  
1645 CH2ClCHCl2 1,1,2-trichloroethane ch2clchcl2  
1646 CH3CCl3 Ethane, 1,1,1-trichloro- ch3ccl3  
1647 SiCl3CH3 methyltrichlorosilane sicl3ch3  
1648 CH3CBr3 1,1,1-tribromoethane ch3cbr3  
1649 NH3BCl3 Amminetrichloroboron nh3bcl3  
1650 SiH3CCl3 (trichloromethyl)silane sih3ccl3  
1651 CH2CClCHCH2 1,3-Butadiene, 2-chloro- c4h5cl  
1652 C3H5ClO Oxirane, (chloromethyl)- c106898  
1653 CH2FCH2CH2F 1,3-difluoropropane ch2fch2ch2f  
1654 CH3CF2CH3 2,2-difluoropropane ch3cf2ch3  
1655 CH2ClCH2CH2Cl 1,3-dichloropropane prdicl13  
1656 CH2ClCHClCH3 Propane, 1,2-dichloro- prdicl12  
1657 CH3CCl2CH3 Propane, 2,2-dichloro- prdicl22  
1658 CHCl2CH2CH3 1,1-dichloropropane prdicl11  
1659 SiCl2(CH3)2 dichlorodimethylsilane sicl2me2  
1660 CH2CClCH2CH3 1-Butene, 2-chloro- bute1cl2  
1661 CH2CHCH2CH2Cl 1-Butene, 4-chloro- bute1cl4  
1662 CH2CHCHClCH3 1-Butene, 3-chloro- bute1cl3  
1663 CH2ClCHCHCH3 2-Butene, 1-chloro- bute2cl1  
1664 CH3CClCHCH3 2-Butene, 2-chloro-, (E)- bute2cl2e  
1665 CH3CClCHCH3 2-Butene, 2-chloro-, (Z)- bute2cl2z  
1666 CHClCHCH2CH3 (E)-1-Chloro-1-butene bute1cl1  
1667 CHClCHCH2CH3 (Z)-1-Chloro-1-butene bute1cl1z  
1668 C4H9F 1-fluorobutane butaf1  
1669 CH3CHFCH2CH3 2-fluorobutane butaf2  
1670 CH2ClCH2CH2CH3 Butane, 1-chloro- butacl1  
1671 CH3CCl(CH3)CH3 Propane, 2-chloro-2-methyl- procl2me2  
1672 CH3CHClCH2CH3 Butane, 2-chloro- butacl2  
1673 XeF4 Xenon tetrafluoride xef4  
1674 C2H2N2O Furazan furazan  
1675 CF3PH2 phosphine, (trifluoromethyl)- cf3ph2  
1676 NH3BF3 Amminetrifluoroboron nh3bf3  
1677 C6H2 hexatriyne c6h2  
1678 C6H4 (E)-Hexa-1,5-diyne-3-ene c6h4e  
1679 C6H4 (Z)-Hexa-1,5-diyne-3-ene c6h4z  
1680 C6H4 Benzyne benzyne  
1681 C6H5 phenyl phenyl  
1682 C6H5- phenyl anion phenyl-  
1683 C6H6 Prismane prismane  
1684 C6H6 1,2,4,5-Hexatetraene ht1245  
1685 C6H6 2,4-Hexadiyne hexadiyne  
1686 C6H6 3,4-Dimethylenecyclobutene cb34m  
1687 C6H6 Benzene benzene  
1688 C6H6 Benzvalene bv  
1689 C6H6 Dewar Benzene dewar  
1690 C6H6 Hexa-1,5-diene-3-yne hdy153  
1691 C6H6 Trimethylenecycopropane tmcp  
1692 C6H6+ Benzene cation c6h6+  
1693 C6H7+ benzene, protonated c6h7+  
1694 C6H8 (E)-hexa-1,3,5-triene c821078  
1695 C6H8 (E)-hexa-2,3,4-triene c59660650  
1696 C6H8 (Z)-hexa-1,3,5-triene hexatri135  
1697 C6H8 (Z)-hexa-2,3,4-triene hetr234c  
1698 C6H8 1,3-Cyclohexadiene cyhexadiene13  
1699 C6H8 1,4-Cyclohexadiene cyhexadiene14  
1700 C6H8 3-Methylenecyclopentene c930267  
1701 C6H8 Bicyclo[2.1.1]hex-2-ene c822413  
1702 C6H8 Bicyclo[2.2.0]hex-1(4)-ene c30830207  
1703 C6H8 Bicyclo[3.1.0]hex-2-ene c694019  
1704 C6H10 1,3-Hexadiene, (E)- hexdi13e  
1705 C6H10 1,3-Hexadiene, (Z)- hexdi13z  
1706 C6H10 1,4-Hexadiene, (E)- hexdi14t  
1707 C6H10 1,4-Hexadiene, (Z)- hexdi14z  
1708 C6H10 1,5-Hexadiene c592427  
1709 C6H10 1-Butyne, 3,3-dimethyl- c917920  
1710 C6H10 1-Hexyne hexyne1  
1711 C6H10 2,4-Hexadiene, (E,E)- hexdi24ee  
1712 C6H10 2,4-Hexadiene, (E,Z)- hexdi24ez  
1713 C6H10 2,4-Hexadiene, (Z,Z)- hexdi24zz  
1714 C6H10 2-Hexyne c764352  
1715 C6H10 3-Hexyne hexyne3  
1716 C6H10 cyclohexene cyclohexene  
1717 C6H10 Cyclopentene, 1-methyl- c693890  
1718 C6H10 Cyclopentene, 3-methyl- c1120623  
1719 C6H10 Cyclopentene, 4-methyl- c1759815  
1720 C4H6(CH3)2 1,1-dimethylcyclobutane dmcb11  
1721 C6H12 (1R,2R)-1,2-dimethylcyclobutane dmcb12t  
1722 C6H12 (1r,3r)-1,3-dimethylcyclobutane dmcb13t  
1723 C6H12 (E)-2-Hexene e2hexene  
1724 C6H12 (E)-3-methylpent-2-ene c616126  
1725 C6H12 (E)-hex-3-ene e3hexene  
1726 C6H12 (Z)-3-methylpent-2-ene c922623  
1727 C6H12 (Z)-hex-2-ene z2hexene  
1728 C6H12 (Z)-hex-3-ene z3hexene  
1729 C6H12 2,3-dimethylbut-1-ene c563780  
1730 C6H12 2,3-dimethyl-but-2-ene tmeet  
1731 C6H12 3-methylenepentane c760214  
1732 C6H12 cis-1,2-dimethylcyclobutane dmcb12c  
1733 C6H12 cis-1,3-dimethylcyclobutane dmcb13c  
1734 C6H12 Cyclohexane cyclohexane  
1735 C6H12 Cyclopentane, methyl- c96377  
1736 C6H12 Ethylcyclobutane c4806615  
1737 C6H12 hex-1-ene hexene1  
1738 C6H14 Butane, 2,2-dimethyl- buta22  
1739 C6H14 Butane, 2,3-dimethyl- buta23  
1740 C6H14 Hexane hexane  
1741 C6H14 Pentane, 2-methyl- penta2  
1742 C6H14 Pentane, 3-methyl- penta3  
1743 C4N2 2-Butynedinitrile c4n2  
1744 N3P3 1,3,5,2,4,6-Triazatriphosphorine n3p3  
1745 C4H2N2 Fumaronitrile c4h2n2  
1746 C2H2N4 sym-tetrazine ttz  
1747 C3H3N3 1,3,5-Triazine triazine135  
1748 CH3N5 5-Aminotetrazole c4418615  
1749 C4H4N2 1,3-Diazine diazine13  
1750 C4H4N2 Pyrazine pyrazine  
1751 C4H4N2 Pyridazine pyridazine  
1752 C4H4N2 Succinonitrile c110612  
1753 C2H4N4 1H-Tetrazole, 1-methyl- c16681779  
1754 C2H4N4 1H-Tetrazole, 5-methyl- c4076362  
1755 C2H4N4 2H-Tetrazole, 2-methyl- c16681780  
1756 C5H5N Bicyclo[1.1.0]butane-1-carbonitrile bibucn  
1757 C5H5N E-2,4-pentadienenitrile bdcn  
1758 C5H5N Pyridine pyridine  
1759 B3N3H6 borazine borazine  
1760 C6H6 Fulvene fulvene  
1761 C5H6N+ Pyridinium c5h6n  
1762 C4H6N2 1H-Imidazole, 2-methyl- c693981  
1763 C5H7N (E)-2-Pentenenitrile c26294984  
1764 C5H7N (E)-3-Pentenenitrile c16529661  
1765 C5H7N (Z)-2-Pentenenitrile c25899507  
1766 C5H7N 1H-Pyrrole, 1-methyl- c96548  
1767 C5H7N Cyclobutanecarbonitrile c4426113  
1768 C5H9N 1,2,3,6-Tetrahydropyridine c694053  
1769 C5H9N Butanenitrile, 2-methyl- c18936179  
1770 C5H9N Pentanenitrile c110598  
1771 C5H9N Propanenitrile, 2,2-dimethyl- c630182  
1772 C6H10 Bicyclo[3.1.0]hexane c285585  
1773 C5H11N Cyclopentanamine cypentam  
1774 C5H11N Piperidine piper  
1775 C4H12N2 1,2-Butanediamine c4426486  
1776 C4H12N2 2-Methyl-1,2-propanediamine c811938  
1777 Li2CO3 Lithium Carbonate li2co3  
1778 Na2CO3 Sodium Carbonate na2co3  
1779 C2O4-- oxalate anion c2o4  
1780 MgSO4 Magnesium Sulfate mgso4  
1781 N2O4 Dinitrogen tetroxide n2o4  
1782 C3H2O3 vinylene carbonate vica  
1783 C2H2O4 Oxalic Acid oxalic  
1784 C2H3NO3 Oxamic acid oxamic  
1785 C4H4O2 2(5H)-Furanone furanone  
1786 C4H4O2 2-Oxetanone, 4-methylene- c674828  
1787 C2H4N2O2 Oxalamide oxalamide  
1788 C2H4N2S2 Ethanedithioamide c79403  
1789 C2H4CO3 Ethylene carbonate etco3  
1790 C3H4O2S 2H-Thiete-1,1-dioxide c7285327  
1791 C3H4S3 1,3-Dithiolane-2-thione c822388  
1792 C2H4O4 Formic acid dimer fadimer  
1793 C4H5NO 3-Methylisoxazole isox3m  
1794 C4H5NO Isoxazole, 5-methyl- c5765446  
1795 C4H5NS 4-Methylthiazole c693958  
1796 C2H5NO3 Nitric acid, ethyl ester c625581  
1797 C5H6O 2H-Pyran pyran2  
1798 C5H6O 2-methylfuran furan2m  
1799 C5H6O 3-Methylfuran furan3m  
1800 C5H6O Pentadienal pdal  
1801 C5H6S Thiophene, 2-methyl- c554143  
1802 C5H6S Thiophene, 3-methyl- c616444  
1803 C4H6O2 γ–Butyrolactone c96480  
1804 C4H6O2 2,3-Butanedione c431038  
1805 C4H6O2 2-Propenoic acid, methyl ester c96333  
1806 C4H6O2 Crotonic Acid crot  
1807 C4H6OS 2,3-dihydrothiophene-2-ol c9000117  
1808 C4H6OS 2,5-dihydrothiophene-3-ol c9000093  
1809 C4H6OS 4,5-dihydrothiophene-2-ol c9000106  
1810 C4H6OS 4,5-dihydrothiophene-3-ol c9000082  
1811 C4H6OS Dihydro-2-(3H)-thiophenone c1003107  
1812 C4H6OS Dihydro-3-(2H)-thiophenone c1003049  
1813 C4H6OS Vinyl sulfoxide c1115157  
1814 CH6N4S Carbonothioic dihydrazide thiacarb  
1815 C2H6N2O2 (E)-Azodioxymethane c37765154  
1816 C2H6N2O2 Dimethylnitroamine c4164287  
1817 C3H6O3 1,3,5-Trioxane trioxane  
1818 C3H6S3 1,3,5-Trithiane c3h6s3  
1819 C3H6S3 Carbonotrithioic acid, dimethyl ester c2314489  
1820 C2H6O3S Sulfurous acid, dimethyl ester c616422  
1821 C4H7NO 2-Pyrrolidinone c616455  
1822 C4H7NO Ethoxyacetonitrile etoaccn  
1823 C4H7NO Methacrylamide c79390  
1824 C4H7NO Oxazole, 4,5-dihydro-2-methyl- c1120645  
1825 HCONH2CN2H4 formamide aminomethanimine dimer d13  
1826 C3H7ONO Propyl nitrite prono  
1827 CH3CH(CH3)ONO Isopropyl nitrite c541424  
1828 CH3CH(NH2)COOH Alanine alanine  
1829 CH3NHCH2COOH Sarcosine sarcosine  
1830 NH2CH2CH2COOH β–alanine betaalanine  
1831 NH2COOC2H5 Urethane urethane  
1832 C5H8O 2H-Pyran, 3,4-dihydro- c110872  
1833 C5H8O Cyclopentanone c120923  
1834 C5H8O Furan, 2,3-dihydro-5-methyl- c1487156  
1835 C5H8O Methyl cyclopropyl ketone c765435  
1836 N(CH3)2CONH2 Urea, N,N-dimethyl- c598947  
1837 NH(CH3)CONH(CH3) Urea, N,N'-dimethyl- c96311  
1838 NH2CONHC2H5 Urea, ethyl- c625525  
1839 C4H8O2 1,3-Dioxane dioxan13  
1840 C4H8O2 1,3-Dioxolane, 2-methyl- c497267  
1841 C4H8O2 1,4-Dioxane dioxan14  
1842 C4H8O2 Ethene, 1,1-dimethoxy- c922690  
1843 C4H8O2 Ethyl acetate c141786  
1844 C4H8OS s-Ethyl thioacetate c625605  
1845 C3H8O3 1,2,3-Propanetriol glycerin  
1846 C3H8O2S (Methylsulfonyl)ethane c594434  
1847 C4H9NO Butanamide c541355  
1848 C4H9NO Propanamide, 2-methyl- c563837  
1849 C5H10O 2-Butanone, 3-methyl- c563804  
1850 C5H10O 2H-Pyran, tetrahydro- c142687  
1851 C5H10O 2-methylbutyraldehyde 2meba  
1852 C5H10O 2-Pentanone mpk  
1853 C5H10O 3-Pentanone dek  
1854 C5H10O Cyclopentanol c96413  
1855 C5H10O Oxetane, 3,3-dimethyl- c6921353  
1856 C5H10O Pentanal pal  
1857 C5H10S 2H-Thiopyran, tetrahydro- c1613510  
1858 C5H10S 3-Ethylthio-1-propene c5296628  
1859 C5H10S Cyclopentanethiol c1679078  
1860 C5H10S Thiophene, tetrahydro-2-methyl- c1795091  
1861 C5H10S Thiophene, tetrahydro-3-methyl- c4740005  
1862 C4H10O2 1,1-Dimethoxyethane c534156  
1863 C4H10O2 1,3-Butanediol budiol13  
1864 C4H10O2 1,4-Butanediol budiol14  
1865 C4H10O2 Ethane, 1,2-dimethoxy- c110714  
1866 C4H10OS Diethyl sulfoxide c70291  
1867 C4H10S2 1,4-Butanedithiol budisl14  
1868 C4H11NO Diethylhydroxylamine c3710847  
1869 C5H12O 1-Butanol, 2-methyl- c137326  
1870 C5H12O 1-Butanol, 3-methyl- c123513  
1871 C5H12O 1-Pentanol pentanol1  
1872 C5H12O 2-Butanol, 3-methyl- c598754  
1873 C5H12O 2-Pentanol peol2  
1874 C5H12O 3-Pentanol pentan3ol  
1875 C5H12O Butane, 1-methoxy- meobu  
1876 C5H12O Propane, 1-ethoxy- proet  
1877 C5H12O Propane, 2-methoxy-2-methyl- c1634044  
1878 C5H12S 1-Butanethiol, 2-methyl- c1878188  
1879 C5H12S 1-Butanethiol, 3-methyl- c541311  
1880 C5H12S 1-Pentanethiol c110667  
1881 C5H12S 1-Propanethiol, 2,2-dimethyl- c1679089  
1882 C5H12S 2-Butanethiol, 2-methyl- c1679090  
1883 C5H12S 2-Butanethiol, 3-methyl- c2084186  
1884 C5H12S Butane, 1-(methylthio)- c628295  
1885 C5H12S Ethyl propyl sulfide c4110503  
1886 C5H12S Propane, 2-(ethylthio)- c5145993  
1887 C5H12S Propane, 2-methyl-2-(methylthio)- c6163640  
1888 C4F2 difluorobutadiyne c4f2  
1889 ClCOClCO Oxalyl chloride oxcl  
1890 CF3CN Acetonitrile, trifluoro- cf3cn  
1891 CF3CN+ Acetonitrile, trifluoro- cation cf3cn+  
1892 B2F4 Diboron tetrafluoride b2f4  
1893 B2Cl4 Diboron tetrachloride b2cl4  
1894 C2F4 Tetrafluoroethylene c2f4  
1895 C2F4+ Tetrafluoroethylene cation c2f4+  
1896 C2ClF3 Ethene, chlorotrifluoro- c2f3cl  
1897 CF2CCl2 difluorodichloroethylene cf2ccl2  
1898 CFClCClF trans-1,2-dichloro-1,2-difluoroethylene cfclcclf  
1899 CFClCFCl cis-1,2-dichloro-1,2-difluoroethylene cfclcfcl  
1900 C2FCl3 fluorotrichloroethene c2fcl3  
1901 C2Cl4 Tetrachloroethylene c2cl4  
1902 C2Br4 tetrabromoethene c2br4  
1903 CF3OF Trifluoromethylhypofluorite cf3of  
1904 SOF4 Sulfur tetrafluoride oxide sof4  
1905 PF5 Phosphorus pentafluoride pf5  
1906 AsF5 Arsenic pentafluoride asf5  
1907 PCl5 Phosphorus pentachloride pcl5  
1908 SF5 Sulfur pentafluoride sf5  
1909 SF5+ pentafluoro sulfur cation sf5+  
1910 SbCl5 Antimony pentachloride sbcl5  
1911 BrF5 bromine pentafluoride brf5  
1912 ClF5 chlorinepentafluoride clf5  
1913 IF5 pentafluoroiodine if5  
1914 CF3CHO trifluoroacetaldehyde cf3cho  
1915 CCl3CHO trichloroacetaldehyde ccl3cho  
1916 CHFClCHClF ethane, 1,2-dichloro-1,2-difluoro- chfclchclf  
1917 CF3CH2F 1,1,1,2-tetrafluoroethane cf3ch2f  
1918 CHF2CHF2 1,1,2,2-tetrafluoroethane chf2chf2  
1919 CF3CH2Cl 2,2,2-Trifluoroethyl chloride cf3ch2cl  
1920 CHFClCHFCl 1,2-dichloro-1,2-difluoroethane RR chfclchfcl  
1921 CH2ClCCl3 1,1,1,2-tetrachloroethane ch2clccl3  
1922 CHCl2CHCl2 Ethane, 1,1,2,2-tetrachloro- chcl2chcl2  
1923 CH2BrCBr3 1,1,1,2-tetrabromo ethane c2h2br4  
1924 CHCl2CHF2 1,1-dichloro-2,2-difluoroethane c2h2cl2f2  
1925 CF3COOH trifluoroacetic acid cf3cooh  
1926 C4H3ClO Furan, 2-chloro fur2cl  
1927 C4H3ClO Furan,3-chloro fur3cl  
1928 C3H5ClO2 Carbonochloridic acid, ethyl ester c541413  
1929 C3H5Cl3 Propane, 1,2,3-trichloro- prcl135  
1930 C4H8Cl2 1,4-Dichlorobutane c110565  
1931 C4H8Cl2 Butane, 1,2-dichloro- c616217  
1932 C4H8Cl2 Butane, 1,3-dichloro- c1190223  
1933 C4H8Cl2 Butane, 2,3-dichloro-, (r*,r*)-(.+/-.)- c2211678  
1934 C4H8Cl2 Butane, 2,3-dichloro-, (r*,s*)- c4028562  
1935 C4H9ClO 1-Chloro-2-ethoxyethane c628342  
1936 C5H11Cl Pentane, 1-chloro- pencl1  
1937 C4H8O2 Butanoic acid bua  
1938 C6H5CH2 benzyl radical benzyl  
1939 C7H7 cycloheptatrienyl radical c7h7  
1940 C7H7+ cycloheptatrienyl cation c7h7+  
1941 C6H5CH3 toluene toluene  
1942 C7H8 cycloheptatriene cht  
1943 C7H8 Norbornadiene norbor  
1944 C7H8 Quadricyclane qucy  
1945 C7H12 Norbornane nor  
1946 C7H14 cycloheptane c7h14  
1947 C7H16 2-methylhexane 2mhex  
1948 C7H16 3-methylhexane hex3m  
1949 C7H16 heptane heptane  
1950 CH(CN)3 tricyanomethane mecn3  
1951 HN=C=C(CN)2 Dicyanoketenimine c4hn3  
1952 C6H7N 2-Methylpyridine mp  
1953 C6H5NH2 aniline aniline  
1954 C6H13N 2-Methylpiperidine pip2m  
1955 C6H13N cyclohexanamine cham  
1956 C6H15N triethylamine tea  
1957 N2O5 Dinitrogen pentoxide n2o5  
1958 C4H2O3 Maleic Anhydride malan  
1959 C5H4O2 4-Cyclopentene-1,3-dione cpdio  
1960 C5H4O2 furfural furfural  
1961 C6H5O phenoxy radical phenoxy  
1962 C5H5NO 2(1H)-Pyridinone c72762006  
1963 C5H5NO 2(3H)-Pyridinone c9000048  
1964 C5H5NO 2(5H)-Pyridinone c9000037  
1965 C5H5NO 2-Pyridinol c109104  
1966 C5H5NO 3(2H)-Pyridinone c9000004  
1967 C5H5NO 3(4H)-Pyridinone c9000026  
1968 C5H5NO 3(6H)-Pyridinone c9000015  
1969 C5H5NO 3-Pyridinol c109002  
1970 C5H5NO 4(1H)-Pryidinone c9000060  
1971 C5H5NO 4(3H)-Pryidinone c9000059  
1972 C5H5NO 4-Pyridinol c626642  
1973 C6H5OH phenol phenol  
1974 C6H6O 2,4-Cyclohexadienone c24599573  
1975 C6H6O 2,5-Cyclohexadienone c5664335  
1976 C6H5SH Benzenethiol phsh  
1977 HO2CCHNH2CH2OH Serine serine  
1978 C5H8O2 Acetylacetone acac  
1979 C4H8O2S Sulfolane sulfolane  
1980 C7H10 Norbornene norbornene  
1981 CH(C2H3)3 trivinyl methane tvm  
1982 C6H10O cyclohexanone chexo  
1983 C6H12O hexanal c6h12o  
1984 C6H12O Oxepane oxepane  
1985 C3H7OC3H7 di-n-propyl ether propr  
1986 F2CCCF2 tetrafluoroallene pfa  
1987 CF3COO- trifluoro acetate anion cf3coo-  
1988 CF3COF trifluoroacetyl fluoride cf3cof  
1989 CF3COCl trifluoroacetyl chloride cf3cocl  
1990 PF6 Hexafluorophosphate neutral pf6  
1991 PF6- Hexafluorophosphate ion pf6-  
1992 SF6 Sulfur Hexafluoride sf6  
1993 SeF6 Selenium hexafluoride sef6  
1994 SF5Cl sulfur chloropentafluoride sf5cl  
1995 CF3CHF2 pentafluoroethane cf3chf2  
1996 CF3CHFCl 1,1,1,2-tetrafluorochloroethane cf3chfcl  
1997 CF3CHCl2 1,1-Dichloro-2,2,2-trifluoroethane cf3chcl2  
1998 CHCl2CClF2 Ethane, 1,2,2-trichloro-1,1-difluoro- chcl2cclf2  
1999 CCl3CHCl2 pentachloroethane ccl3chcl2  
2000 C6H5F Fluorobenzene bzf  
2001 C6H5Cl chlorobenzene bzcl  
2002 C6H5Br bromobenzene bzbr  
2003 C8H6 Calicene calicene  
2004 C6H5CCH phenylacetylene phac  
2005 C8H6 benzocyclobutadiene bcbd  
2006 C8H6 Pentalene pentalene  
2007 C6H5CHCH2 Styrene styrene  
2008 C8H8 cubane cubane  
2009 C8H8 cyclooctatetraene cot  
2010 C6H5CH2CH3 Ethylbenzene etbz  
2011 CH3C6H4CH3 meta-xylene mxylene  
2012 CH3C6H4CH3 paraxylene pxylene  
2013 C8H14 Bicyclo[2.2.2]octane bico222  
2014 C8H16 cyclooctane cyclooct  
2015 (CH3)3CC(CH3)3 tetramethylbutane tmb  
2016 C8H18 Octane c8h18  
2017 C6H5CN phenyl cyanide phcn  
2018 C6H12N2 Triethylenediamine ted  
2019 C4O4-- squarate dianion c4o4--  
2020 S4N4 Tetrasulfur tetranitride s4n4  
2021 S8 Octasulfur s8  
2022 C6H4O2 parabenzoquinone pbq  
2023 C4H4N2O2 Uracil uracil  
2024 C6H5CHO benzaldehyde benzal  
2025 C6H5OCH3 Anisole anisole  
2026 C5H9NO2 Proline proline  
2027 C6H12O2 Methyl pivalate c598981  
2028 C6H12O2 Hexanoic acid hexa  
2029 C4F4 tetrafluorcyclobutadiene c4f4  
2030 Al2Cl6 Aluminum, di-μ-chlorotetrachlorodi- al2cl6  
2031 CF3CF2Cl pentafluorochloroethane cf3cf2cl  
2032 CF2ClCF2Cl 1,2-Dichloro-1,1,2,2-tetrafluoroethane cf2clcf2cl  
2033 CF3CFCl2 1,1-Dichlorotetrafluoroethane cf3cfcl2  
2034 CF2ClCFCl2 Ethane, 1,1,2-trichloro-1,2,2-trifluoro- cf2clcfcl2  
2035 CF3CCl3 1,1,1-trifluoro-2,2,2-trichloroethane cf3ccl3  
2036 C2F6 hexafluoroethane c2f6  
2037 C2Cl6 hexachloroethane c2cl6  
2038 IF7 Iodine heptafluoride if7  
2039 C6H4F2 metadifluorobenzene mdfb  
2040 C6H4F2 orthodifluorobenzene odfb  
2041 C6H4F2 1,4-difluorobenzene pdfb  
2042 C6H4Cl2 1,2-dichlorobenzene dcb12  
2043 C6H4Cl2 1,3-dichlorobenzene dcb13  
2044 C6H4Cl2 1,4-dichlorobenzene dcb14  
2045 C6H5NO nitrosobenzene bzno  
2046 C9H8 Indene indene  
2047 C9H8 spiro[4.4]nona-1,3,6,8-tetraene snt  
2048 C9H12 n-propyl benzene prbz  
2049 C9H20 Nonane nonane  
2050 C(CN)4 tetracyanomethane c5n4  
2051 C5H4N4 purine purine  
2052 C8H7N Indole indole  
2053 C3H3N3O3 cyanuric acid cyanuric  
2054 C6H5NO2 Nitrobenzene c6h5no2  
2055 C6H5COOH benzoic acid benzo  
2056 CH3COC6H5 acetophenone acph  
2057 C3Cl3N3 1,3,5-Triazine, 2,4,6-trichloro- c3cl3n3  
2058 C3F6 hexafluoropropene c3f6  
2059 C6H3F3 Benzene trifluoride 123 bzf3a  
2060 C8H18O 1-Octanol octanol  
2061 C10H8 Azulene azu  
2062 C10H8 naphthalene naph  
2063 C10H10 bullvalene bullv  
2064 C10H16 adamantane adamantane  
2065 C6N4 Tetracyanoethylene tcne  
2066 C6N4- tetracyanoethylene anion tcne-  
2067 C10H22 Decane decane  
2068 C4F6 perfluorobutadiene c4f6  
2069 SF5CF3 Sulfur, pentafluoro(trifluoromethyl)- sf5cf3  
2070 C3F8 perfluoropropane c3f8  
2071 Fe(CO)5 Iron pentacarbonyl ipc  
2072 Fe(C5H5)2 ferrocene fecp2  
2073 B12H12-- Dodecahydrododecaborate(2-) b12h12--  
2074 B12H12-- Dodecahydrododecaborate(2-) b12h12--  
2075 C12H8 Acenaphthylene acenaph  
2076 C12H8 biphenylene biph  
2077 C12H10 biphenyl biphenyl  
2078 C12H10 Heptalene heptalene  
2079 C6H12O6 Inositol inositol  
2080 C6F6 hexafluorobenzene c6f6  
2081 S2F10 disulphur decafluoride s2f10  
2082 C13H10 Fluorene fluorene  
2083 C14H10 Anthracene anth  
2084 C14H10 Phenanthrene phenanthrene  
2085 C14H14 Bibenzyl bibenzyl  
2086 C12H10N2 azobenzene azobenzene  
2087 C6H5COC6H5 benzophenone benzophenone  
2088 C16H10 Pyrene pyrene  
2089 C18H12 Tetracene tetracene  
2090 C19H16 Triphenylmethane tpm  
2091 C24H12 Coronene coronene  
2092 C60 Buckminsterfullerene c60