III.F.1. (I.A.4.)

List of which calculations are completed at CCSD(T)=FULL /daug-cc-pVDZ

count	Species	Name	State	Conformation
1	H	Hydrogen atom	¹S	K_h
2	H^-	Hydrogen atom anion	²S	K_h
3	H₂	Hydrogen diatomic	¹Σ_g	D_∞h
4	H₂^-	hydrogen diatomic anion	²Σ_u⁺	D_∞h
5	He	Helium atom	¹S	K_h
6	He	Helium atom
7	He⁺	Helium atom cation	²S	K_h
8	Li^-	Lithium atom anion	¹S	K_h
9	LiH	Lithium Hydride	¹Σ	C_∞v
10	MgH	magnesium monohydride	²Σ	C_∞v
11	ZnH⁺	Zinc, protonated
12	Al^-	Aluminum atom anion	³P	K_h
13	Al⁺	Aluminum atom cation	¹S	K_h
14	Ga	Gallium atom	²P
15	Ga^-	Gallium atom anion	³P	O_h
16	Ga⁺	Gallium atom cation	¹S
17	GaH	Gallium monohydride	¹Σ	C_∞v
18	GaH⁺	Gallium monohydride cation	²Σ	C_∞v
19	AlH₃^-	aluminum trihydride anion		C_3v
20	C	Carbon atom	³P₀	K_h
21	Si^-	Silicon atom anion	⁴S	K_h
22	Ge	Germanium atom	³P	K_h
23	Ge^-	Germanium anion	⁴S	K_h
24	Ge⁺	Germanium cation	²P	K_h
25	CH	Methylidyne	²Π_1/2	C_∞v
26	SiH	Silylidyne	²Π	C_∞v
27	GeH	germylidene	²Π	C_∞v
28	CH₂^-	methylene anion	²B₁	C_2v
29	GeH₂	germylene	¹A₁	C_2v
30	CH₃^-	methyl anion	¹A₁	C_3v
31	SiH₃	Silyl radical	²A₁	C_3v
32	GeH₃	Germyl radical	²A₁	C_3v
33	GeH₃⁺	germyl cation	¹A₁^'	D_3h
34	CH₄	Methane	¹A₁	T_d
35	SiH₂D₂	silane-d2
36	SiH₅⁺	Silane, protonated
37	N	Nitrogen atom	⁴S	K_h
38	As	Arsenic atomic	⁴S	K_h
39	As^-	Arsenic anion	³P	K_h
40	As⁺	Arsenic cation	³P	K_h
41	PH	phosphorus monohydride	³Σ^-	C_∞v
42	AsH	Arsenic monohydride	³Σ	C_∞v
43	NH₂	Amino radical	²B₁	C_2v
44	NH₃	Ammonia	¹A₁	C_3v
45	PH₃⁺	Phosphine cation	²A₁	C_3v
46	AsH₃⁺	Arsine cation	²A₁	C_3v
47	AsH₄⁺	Arsonium
48	NH₄	Ammonium radical
49	PH₄	Phosphoranyl radical
50	O	Oxygen atom	³S	K_h
51	S	Sulfur atom	³P	K_h
52	S	Sulfur atom
53	S^-	Sulfur atom anion	²P	K_h
54	Se	Selenium atom	³P	K_h
55	Se^-	Selenium atom anion	²P	K_h
56	Se⁺	Selenium atom cation	⁴S	K_h
57	OH	Hydroxyl radical	²Π	C_∞v
58	OH^-	hydroxide anion	¹Σ	C_∞v
59	OH⁺	hydoxyl cation	³Σ	C_∞v
60	HSe	Selenium monohydride	²Π	C_∞v
61	HSe^-	selenium monohydride anion	¹Σ	C_∞v
62	HSe⁺	selenium monohydride cation	³Σ	C_∞v
63	H₂O	Water	¹A₁	C_2v
64	H₂O^-	water anion	²A₁	C_2v
65	H₂O^-	water anion	²A^'	C_s
66	H₂S	Hydrogen sulfide	¹A₁	C_2v
67	H₂Se	Hydrogen selenide	¹A₁	C_2v
68	H₂Se⁺	Hydrogen selenide cation	²B₁	C_2v
69	H₃Se⁺	Hydrogen Selenide, protonated	¹A₁	C_3v
70	F	Fluorine atom	²P	K_h
71	F^-	Fluorine atom anion	¹S	K_h
72	Cl	Chlorine atom	²P	K_h
73	Cl^-	Chlorine atom anion	¹S	K_h
74	Br	Bromine atom	²P	K_h
75	Br^-	Bromine atom anion	¹S	K_h
76	Br⁺	Bromine atom cation	³P	K_h
77	HF	Hydrogen fluoride	¹Σ	C_∞v
78	HF^-	hydrogen fluoride anion	²Σ	C_∞v
79	HF⁺	hydrogen fluoride cation	²Π	C_∞v
80	HCl	Hydrogen chloride	¹Σ	C_∞v
81	HCl^-	hydrogen chloride anion	²Σ	C_∞v
82	HCl⁺	hydrogen chloride cation	²Π	C_∞v
83	HBr	hydrogen bromide	¹Σ	C_∞v
84	HBr^-	hydrogen bromide anion	²Σ	C_∞v
85	HBr⁺	hydrogen bromide cation	²Π	C_∞v
86	H₂Br⁺	protonated hydrogen bromide	²A₁	C_2v
87	Ne	Neon atom
88	HeLi⁺	Helium Lithium cation
89	ArH⁺	Argon hydride cation	¹Σ	C_∞v
90	NaLi	lithium sodium	¹Σ	C_∞v
91	Na₂	Sodium diatomic	¹Σ_g	D_∞h
92	Na₂^-	sodium diatomic anion	²Σ_u	D_∞h
93	LiAl	Lithium Aluminum
94	HBBH	Diborane(2)	³Σ_G	D_∞h
95	B₂H₄	Diborane(4) D2d	¹A₁	D_2d
96	B₂H₆	Diborane	¹A_g	D_2h
97	B₂H₆⁺	Diborane cation
98	GeC	Germanium monocarbide	¹Σ	C_∞v
99	SiGe	Silicon Germanium
100	C₂H^-	Ethynyl anion	¹Σ	C_∞v
101	C₂H₂⁺	acetylene cation	²Π_u	D_∞h
102	C₂H₂⁺	acetylene cation
103	Si₂H₂	disilyne
104	Si₂H₂	disilyne
105	Si₂H₂	disilyne
106	Si₂H₂	disilyne
107	CH₃Li	methyl lithium	¹A₁	C_3v
108	C₂H₃⁺	vinyl cation	¹A₁	C2V bridging H
109	C₂H₃⁺	vinyl cation	¹A₁	C2V HCCH2
110	C₂H₄	Ethylene	¹A_g	D_2h
111	Si₂H₄	Disilene
112	Si₂H₄	Disilene
113	Si₂H₄	Disilene
114	C₂H₆	Ethane	¹A_1g	D_3d
115	Si₂H₆	disilane	¹E_u	D_3d
116	LiN	Lithium Nitride	³Σ	C_∞v
117	LiP	Lithium monophosphide
118	LiP	Lithium monophosphide
119	MgN	Magnesium Nitride
120	GaAs	Gallium arsenide	³Π
121	GaAs	Gallium arsenide	¹Σ
122	CN	Cyano radical	²Σ	C_∞v
123	SiP	Silicon monophosphide	²Π	C_∞v
124	N₂	Nitrogen diatomic	¹Σ_g	D_∞h
125	N₂	Nitrogen diatomic
126	N₂^-	nitrogen diatomic anion	²Π_g	D_∞h
127	PN	Phosphorus mononitride	¹Σ	C_∞v
128	HCN	Hydrogen cyanide	¹Σ	C_∞v
129	HNC⁺	hydrogen isocyanide cation
130	HCP⁺	Phosphaethyne cation
131	NNH⁺	Dinitrogen monohydride cation	¹Σ	C_∞v
132	LiNH₂	lithium amide
133	H₂NN	Isodiazene
134	CH₂NH	Methanimine	¹A^'	C_s
135	CH₂NH⁺	Methanimine cation
136	CHNH₂	aminomethylene
137	CHNH₂⁺	Aminocarbene cation
138	BH₂NH₂	Boranamine
139	CH₃NH₂	methyl amine	¹A^'	C_s
140	SiH₃NH₂	Silane, amino
141	BH₃PH₃	borane phosphine
142	LiSe	Lithium monoselenide
143	GaO	Gallium monoxide	²Σ	C_∞v
144	GaS	Gallium monosulfide
145	CO	Carbon monoxide	¹Σ	C_∞v
146	CO⁺	carbon monoxide cation	²Σ	C_∞v
147	SiO	Silicon monoxide	¹Σ	C_∞v
148	SiS	silicon monosulfide	¹Σ	C_∞v
149	CSe	Carbon monoselenide	¹Σ	C_∞v
150	GeO	Germanium monoxide	¹Σ	C_∞v
151	SiSe	Silicon Monoselenide
152	SiSe⁺	Silicon Monoselenide cation
153	GeSe	Germanium monoselenide
154	NO	Nitric oxide	²Π	C_∞v
155	NO^-	nitric oxide anion	³Σ	C_∞v
156	PS	phosphorus sulfide	²Σ	C_∞v
157	O₂	Oxygen diatomic	³Σ_g	D_∞h
158	O₂^-	oxygen diatomic anion	²Π	D_∞h
159	O₂^--	dioxygen dianion
160	SO	Sulfur monoxide	³Σ	C_∞v
161	SO	Sulfur monoxide	¹Σ	C_∞v
162	SO⁺	sulfur monoxide cation	²Π	C_∞v
163	S₂	Sulfur diatomic	³Σ_g	D_∞h
164	SeO	Selenium monoxide	³Σ	C_∞v
165	Se₂	Selenium diatomic	³Σ_g	D_∞h
166	BeOH	beryllium monohydroxide	²A^'	C_s
167	HBS	hydrogen boron sulfide	¹Σ	C_∞v
168	COH	Hydroxymethylidyne
169	HCO	Formyl radical	²A^'	C_s
170	HCO⁺	Formyl cation	¹Σ	C_∞v
171	HNO	Nitrosyl hydride	¹A^'	C_s
172	HNO⁺	Nitrosyl hydride cation	²A^'	C_s
173	HSO⁺	Sulfur Monoxide, S-protonated
174	SOH	Sulfur Hydroxide
175	SOH⁺	Sulfur Monoxide, protonated
176	H₂CO	Formaldehyde	¹A₁	C_2v
177	H₂CO^-	formaldehyde anion	²A^'	C_s
178	H₂CO^-	formaldehyde anion
179	H₂CO⁺	formaldehyde cation	²B₂	C_2v
180	H₂CS	Thioformaldehyde	¹A₁	C_2v
181	H₂CSe	Selenoformaldehyde
182	H₂O₂	Hydrogen peroxide	¹A	C₂
183	H₂OO	water oxide
184	HOSH	hydrogen thioperoxide
185	H₂Se₂	hydrogen diselenide
186	NH₂OH	hydroxylamine	¹A^'	C_s
187	NH₂OH⁺	Hydroxylamine cation
188	CH₃OH	Methyl alcohol	¹A^'	C_s
189	CH₃OH⁺	Methyl alcohol cation	²A^"	C_s
190	SiH₃OH	silanol
191	NH₂OH₂⁺	protonated hydroxylamine
192	NH₃OH⁺	N-protonated hydroxylamine
193	LiF	lithium fluoride	¹Σ	C_∞v
194	LiCl	lithium chloride	¹Σ	C_∞v
195	NaF⁺	sodium fluoride cation	²Σ	C_∞v
196	LiBr	Lithium Bromide	¹Σ	C_∞v
197	LiF⁺	lithium fluoride cation	²Π	C_∞v
198	BF	Boron monofluoride	¹Σ	C_∞v
199	AlF	Aluminum monofluoride	¹Σ⁺	C_∞v
200	GaF	Gallium monofluoride	¹Σ	C_∞v
201	AlBr	Aluminum monobromide
202	GaCl	Gallium monochloride	¹Σ_G	C_∞v
203	GaBr	Gallium monobromide
204	CF	Fluoromethylidyne	²Π	C_∞v
205	SiCl	Clorosilylidyne	²Π	C_∞v
206	GeF	Germanium monofluoride	²Π	C_∞v
207	GeCl	Germanium monochloride	²Π	C_∞v
208	GeCl⁺	Germanium monochloride cation
209	SiBr⁺	Silicon monobromide cation
210	PBr	Phosphorus monobromide
211	ClO	Monochlorine monoxide	²Π	C_∞v
212	ClO⁺	chlorine monoxide cation	³Σ	C_∞v
213	SF	Monosulfur monofluoride	²Π	C_∞v
214	SF⁺	sulfur monofluoride cation	³Σ	C_∞v
215	SCl⁺	sulfur monochloride cation	³Σ_g	C_∞v
216	BrO	Bromine monoxide	²Π	C_∞v
217	BrO⁺	Bromine monoxide cation
218	SBr	Sulfur monobromide radical
219	SBr⁺	Sulfur monobromide cation
220	SeBr	Selenium monobromide
221	BrCl	Bromine monochloride	¹Σ	C_∞v
222	F₂	Fluorine diatomic	¹Σ_g	D_∞h
223	F₂^-	flourine diatomic anion	²Σ_u	D_∞h
224	F₂⁺	flourine diatomic cation	²Π_g	D_∞h
225	ClF⁺	clorine monofluoride cation	²Π	C_∞v
226	Cl₂	Chlorine diatomic	¹Σ_g	D_∞h
227	Cl₂⁺	chlorine diatomic cation	²Π_g	D_∞h
228	BrF	Bromine monofluoride	¹Σ	C_∞v
229	Br₂	Bromine diatomic	¹Σ_g	D_∞h
230	Br₂^-	bromine diatomic anion	²Σ_u	D_∞h
231	Br₂⁺	bromine diatomic cation	²Π_g	D_∞h
232	HCF	Fluoromethylene	¹A^'	C_s
233	HCF	Fluoromethylene	³A^"	C_s
234	HSiF	fluorosilylene
235	HSiCl	Chlorosilylene
236	HSiBr	monobromosilylene
237	HOF	Hypofluorous acid	¹A^'	C_s
238	HOCl	hypochlorous acid	¹A^'	C_s
239	HOCl⁺	hypochlorous acid cation
240	ClFH⁺	Chlorine fluoride, F-protonated
241	FClH⁺	Chlorine fluoride, Cl-protonated
242	CH₂Br	bromomethyl radical
243	CH₂F⁺	fluoromethyl cation
244	CH₂Cl⁺	chloromethyl cation
245	CH₂Cl	chloromethyl radical	²A^'	C_s
246	CH₂Cl	chloromethyl radical	²B₁	C_2v
247	NH₂Cl	chloramine	¹A^'	C_s
248	CH₃F⁺	methyl fluoride cation
249	CH₃F	Methyl fluoride	¹A₁	C_3v
250	CH₃Cl	Methyl chloride	¹A₁	C_3v
251	SiH₃F	monofluorosilane	¹A₁	C_3v
252	SiH₃Cl	chlorosilane	¹A₁	C₁
253	CH₃Br	methyl bromide	¹A₁	C_3v
254	GeH₃F	monofluorogermane
255	GeH₃Cl	monochlorogermane
256	NH₃Cl⁺	protonated monochloroammonia
257	NH₄Cl	Ammonium chloride
258	Ar₂	Argon diatomic	¹S_g	D_∞h
259	SiC₂	Silicon dicarbide
260	C₃H₄	cyclopropene	¹A₁	C_2v
261	CH₂CCH₂	allene	¹A₁	D_2d
262	CH₃CCH	propyne	¹A^'	C_3v
263	CH₂CHCH₃	Propene	¹A^'	C_s
264	C₃H₇	n-Propyl radical	²A^"	C₁
265	Si₃H₈	trisilane
266	AlCN	Aluminum monocyanide
267	AlNC	Aluminum isocyanide
268	CNN	Diazocarbene
269	HN₃	hydrogen azide	¹A^'	C_s
270	HN₃⁺	Hydrazoic acid cation
271	HNCNH	diiminomethane	¹A	C₂
272	HNNNH⁺	1,2-Triazadienium
273	NH₂NN⁺	hydrazoic acid, protonated
274	CH₃CN	Acetonitrile	¹A₁	C_3v
275	CH₃CN^-	acetonitrile anion	²E	C_3v
276	CH₃CN^-	acetonitrile anion	²A^'	C_s
277	HCNCH₂⁺	2H-Azirine cation
278	NH₂CNH⁺	cyanamide, cn protonated
279	NH₃CN⁺	cyanamide, amine protonated
280	Na₂S	Sodium sulfide
281	Na₂S	Sodium sulfide
282	LiO₂	Lithium dioxide
283	NaO₂	Sodium superoxide
284	N₂O	Nitrous oxide	¹Σ	C_∞v
285	CO₂	Carbon dioxide	¹Σ_g	D_∞h
286	OCS	Carbonyl sulfide	¹Σ	C_∞v
287	CS₂	Carbon disulfide	¹Σ_g	D_∞h
288	GeO₂	Germanium dioxide	¹Σ_g	D_∞h
289	OCSe	Carbonyl selenide	¹Σ	C_∞v
290	SCSe	Carbon sulfide selenide
291	NSO	sulfinyl amidogen
292	SNO	Nitrogen oxide sulfide
293	SO₂	Sulfur dioxide	¹A₁	C_2v
294	SSO	Disulfur monoxide	¹A^'	C_s
295	S₃	Sulfur trimer	¹A₁	C_2v
296	SeO₂	Selenium dioxide	¹A₁	C_2v
297	HCCO	ketenyl radical	²Π	C_∞v
298	HCCO	ketenyl radical	²A^"	C_s
299	HCNO	fulminic acid	¹Σ	C_∞v
300	HOCO	Hydrocarboxyl radical	¹A^'	cis
301	HOCO	Hydrocarboxyl radical	¹A^'	trans
302	O₃H⁺	protonated ozone	¹A^'	C_s
303	O₃H⁺	protonated ozone
304	C₂H₂O	Oxirene	¹A₁	C_2v
305	CH₂CO	Ketene	¹A₁	C_2v
306	CH₂CS	Thioketene
307	HCOOH	Formic acid
308	BH₃CO	Borane carbonyl	¹A₁	C_3v
309	NHCHSH	Methanimidothioic acid
310	C₂H₄O	Ethylene oxide	¹A₁	C_2v
311	C₂H₄O⁺	ethylene oxide cation
312	CH₃CHO	Acetaldehyde	¹A^'	C_s
313	CH₃CHO⁺	acetaldehyde cation
314	H₂COCH₂⁺	Methyl, (methyleneoxoniumyl)-
315	C₂H₄S	Thiirane	¹A₁	C_2v
316	CH₃CHS	Thioacetaldehyde	¹A^'	C₁
317	NH₂CHOH⁺	Formamide, O-protonated
318	CH₃SSH	Hydrogen methyl disulfide
319	HSCH₂SH	Methanedithiol
320	CH₃CH₂SH	ethanethiol	¹A^'	C_s
321	CH₃SCH₃	Dimethyl sulfide	¹A₁	C_2v
322	BrCN	Cyanogen bromide	¹Σ	C_∞v
323	FBO	Boron monofluoride monoxide
324	BeBr₂	Beryllium bromide
325	FNO	Nitrosyl fluoride	¹A^'	C_s
326	ClNO	Nitrosyl chloride	¹A^'	C_s
327	CF₂	Difluoromethylene	¹A₁	D_∞h
328	SiF₂	Silicon difluoride	¹A₁	C_2v
329	GeCl₂	Germanium dichloride	¹A₁	C_2v
330	FOO⁺	Fluorine dioxide cation
331	OClO	Chlorine dioxide	²B₁	D_∞h
332	BrOO	Bromine dioxide
333	OBrO	Bromine dioxide radical	²B₁	C_2v
334	PF₂	Phosphorus difluoride
335	PF₂⁺	Phosphorus difluoride cation
336	SF₂	sulfur difluoride	¹A₁	C_2v
337	SeF₂	Selenium difluoride
338	SeCl₂	Selenium Dichloride
339	SBr₂	Sulfur dibromide
340	SeBr₂	Selenium dibromide
341	Br₃^-	tribromide anion
342	SFCl	Sulfur chloride fluoride
343	HCCF	Fluoroacetylene	¹Σ	C_∞v
344	CHF₂	difluoromethyl radical	²A	C_s
345	CHF₂⁺	difluoromethyl cation
346	CHFCl	Chlorofluoromethyl radical
347	CHFCl⁺	Chlorofluoromethyl cation
348	CHCl₂⁺	dichloromethyl cation
349	NHF₂	difluoramine
350	NHCl₂	dichloroamine
351	CH₂F₂	Methane, difluoro-	¹A₁	C_2v
352	SiH₂F₂	difluorosilane
353	CH₂Cl₂	Methylene chloride	¹A₁	C_2v
354	CH₂Br₂	dibromomethane	¹A₁	C_2v
355	CH₃MgBr	Methyl Magnesium Bromide
356	CH₂CHF	Ethene, fluoro-	¹A^'	C_s
357	CH₂FOH	fluoromethanol
358	C₄	Carbon tetramer	³Σ_g	D_∞h
359	C₄	Carbon tetramer
360	C₄H₂⁺	diacetlyene cation	²Π_g	D_∞h
361	C₄H₄	Tetrahedrane
362	H₂CNCN	cyanamide, methylene
363	HNCCNH	Ethenediimine
364	H₂NCHCHNH₂	diaminoethylene
365	ONNO	NO dimer	¹A_g	trans C2H
366	SO₃	Sulfur trioxide	¹A₁^'	D_3h
367	SO₃^--	Sulfate dianion
368	S₄	Sulfur tetramer
369	S₄	Sulfur tetramer
370	S₄	Sulfur tetramer
371	HNO₃	Nitric acid	¹A^'	C_s
372	C₃H₂O	Propadienal
373	C₃H₂O	Propadienal
374	C₂H₂O₂	Ethanedial	¹A_g	C_2h
375	CH₃NCO	methylisocyante
376	H₃AlO₃	Aluminum hydroxide
377	CH₂CHCHO	Acrolein	¹A^'	C_s
378	CH₂C(OH)NH₂	1-amino vinyl alchohol
379	CH₃C(OH)=NH	Ethaninidic acid
380	CH₃CSNH₂	Ethanethioamide
381	CH₃CH₂CHO	Propanal	¹A^'	C_s
382	Li₂F₂	Lithium fluoride dimer
383	CF₂O	Carbonic difluoride	¹A₁	C_2v
384	CF₂O⁺	Carbonic difluoride cation
385	BF₃⁺	boron trifluoride cation
386	BCl₃	Borane, trichloro-	¹A₁^'	D_3h
387	BCl₃⁺	Boron Trichloride cation
388	GaF₃	Gallium trifluoride	¹A₁^'	D_3h
389	CF₂Cl	difluorochloromethyl radical
390	CFCl₂	dichlorofluoromethyl radical
391	SSCl₂	Thiothionyl chloride
392	NF₃	Nitrogen trifluoride	¹A₁	C_3v
393	CHF₃	Methane, trifluoro-	¹A₁	C_3v
394	SiHF₃	trifluorosilane
395	CHBrF₂	Methane, bromodifluoro-	¹A^'	C_s
396	CHBr₂F	dibromofluoromethane
397	C₂H₄F₂	1,2-difluoroethane	¹A_g	C2H anti
398	CH₂CHCH₂F	Allyl Fluoride
399	CH₂CHCH₂F	Allyl Fluoride
400	CH₂FCH₂CH₃	1-Fluoropropane
401	C₅H₄	pentatetraene
402	C₃O₂	Carbon suboxide	¹Σ_G	D_∞h
403	B₂O₃	diboron trioxide
404	B₂O₃	diboron trioxide
405	CHOOCHO	diformyl ether
406	C₃H₃NO	Isoxazole	¹A^'	C_s
407	C₄H₄Se	selenophene
408	CF₃Cl	Methane, chlorotrifluoro-	¹A₁	C_3v
409	CF₂Cl₂	difluorodichloromethane	¹A₁	C_2v
410	CBr₂ClF	dibromochlorofluoromethane
411	CHF₂CH₂F	Ethane, 1,1,2-trifluoro	¹A	C₁
412	C₆H₆	Prismane
413	N₃P₃	1,3,5,2,4,6-Triazatriphosphorine
414	C₃H₂O₃	vinylene carbonate
415	SF₆	Sulfur Hexafluoride	¹A_1G	O_h
416	C₆H₅CHO	benzaldehyde	¹A^'	C_s

Species NOT done yet

count	Species	Name	file name
1	D	Deuterium atom	d
2	D^-	Deuterium atom anion	d-
3	D⁺	Deuterium atom cation	d+
4	H⁺	Hydrogen atom cation	h+
5	D₂	Deuterium diatomic	d2
6	H₂⁺	Hydrogen cation	h2+
7	HD	Deuterium hydride	hd
8	H₃⁺	hydrogen trimer cation	h3+
9	He^-	Helium atom anion	he-
10	HeH	Helium hydride	heh
11	HeH⁺	Helium hydride cation	heh+
12	He₂⁺	helium diatomic cation	he2+
13	Li	Lithium atom	li
14	Li⁺	Lithium atom cation	li+
15	Na	Sodium atom	na
16	Na^-	Sodium atom anion	na-
17	Na⁺	Sodium atom cation	na+
18	K	Potassium atom	k
19	K^-	Potassium atom anion	k-
20	K⁺	Potassium atom cation	k+
21	Cu	Copper atom	cu
22	Cu^-	Copper atom anion	cu-
23	Cu⁺	Copper atom cation	cu+
24	LiH^-	lithium hydride anion	lih-
25	LiH⁺	lithium hydride cation	lih+
26	NaH	sodium hydride	nah
27	NaH^-	sodium hydride anion	nah-
28	NaH⁺	sodium hydride cation	nah+
29	KH	Potassium hydride	kh
30	KH⁺	Potassium hydrogen cation	kh+
31	CuH	Copper monohydride	cuh
32	Be	Beryllium atom	be
33	Be^-	Beryllium atom anion	be-
34	Be⁺	Beryllium atom cation	be+
35	Mg	Magnesium atom	mg
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	BeH₂	beryllium dihydride	beh2
54	BeH₂⁺	Beryllium dihydride cation	beh2+
55	MgH₂	magnesium dihydride	mgh2
56	CaH₂	Calcium Hydride	cah2
57	ZnH₂	Zinc hydride	znh2
58	B	Boron atom	b
59	B^-	Boron atom anion	b-
60	B⁺	Boron atom cation	b+
61	Al	Aluminum atom	al
62	Sc	Scandium atom	sc
63	Sc⁺	Scandium cation	sc+
64	BH	Boron monohydride	bh
65	BH^-	boron monohydride anion	bh-
66	BH⁺	boron monohydride cation	bh+
67	AlH	aluminum monohydride	alh
68	AlH^-	aluminum monohydride anion	alh-
69	AlH⁺	aluminum monohydride cation	alh+
70	ScH	Scandium monohydride	sch
71	ScH⁺	Scandium monohydride cation	sch+
72	BH₂	boron dihydride	bh2
73	BH₂^-	boron dihydride anion	bh2-
74	BH₂⁺	Boron dihydride cation	bh2+
75	AlH₂	aluminum dihydride	alh2
76	AlH₂^-	aluminum dihydride anion	alh2-
77	AlH₂⁺	aluminum dihydride cation	alh2+
78	BH₃	boron trihydride	bh3
79	BH₃^-	boron trihydride anion	bh3-
80	BH₃⁺	boron trihydride cation	bh3+
81	AlH₃	aluminum trihydride	alh3
82	AlH₃⁺	aluminum trihydride cation	alh3+
83	ScH₃	Scandium trihydride	sch3
84	GaH₃	Gallium trihydride	gah3
85	BH₄	borohydride	bh4
86	BH₄^-	borohydride anion	bh4-
87	AlH₄^-	Aluminum tetrahydride anion	alh4-
88	C^-	Carbon atom anion	c-
89	C⁺	Carbon atom cation	c+
90	Si	Silicon atom	si
91	Si⁺	Silicon atom cation	si+
92	Ti	Titanium atom	ti
93	Ti^-	Titanium atom anion	ti-
94	Ti⁺	Titanium atom cation	ti+
95	Sn	Tin atom	sn
96	Sn⁺	Tin cation	sn+
97	CH^-	methylidyne anion	ch-
98	CH⁺	Methylidyne cation	ch+
99	SiH^-	silicon monohydride anion	sih-
100	SiH⁺	silicon monohydride cation	sih+
101	GeH⁺	Germaniun monohyrdide cation	geh+
102	CH₂	Methylene	ch2
103	CH₂⁺	methylene cation	ch2+
104	SiH₂	silicon dihydride	sih2
105	SiH₂^-	silicon dihydride anion	sih2-
106	SiH₂⁺	silicon dihydride cation	sih2+
107	GeH₂^-	germylene anion	geh2-
108	CH₃	Methyl radical	ch3
109	CH₃⁺	methyl cation	ch3+
110	SiH₃^-	Silyl anion	sih3-
111	SiH₃⁺	Silyl cation	sih3+
112	CD₄	methane-d4	cd4
113	CH₂D₂	methane-d2	ch2d2
114	CH₃D	methane-d	ch3d
115	CH₄^-	Methane anion	ch4-
116	CH₄⁺	Methane cation	ch4+
117	CHD₃	methane-d3	chd3
118	SiH₄	Silane	sih4
119	SiH₄⁺	Silane cation	sih4+
120	GeH₄	Germane	geh4
121	SnH₄	Stannane	snh4
122	N^-	Nitrogen atom anion	n-
123	N⁺	Nitrogen atom cation	n+
124	P	Phosphorus atom	p
125	P^-	Phosphorus atom anion	p-
126	P⁺	Phosphorus atom cation	p+
127	V	Vanadium atom	v
128	V⁺	Vanadium atom cation	v+
129	Sb	Antimony atom	sb
130	NH	Imidogen	nh
131	NH^-	Imidogen anion	nh-
132	NH⁺	imidogen cation	nh+
133	PH^-	phosphorus monohydride anion	ph-
134	PH⁺	phosphorus monohydride cation	ph+
135	AsH⁺	Arsenic monohydride cation	ash+
136	SbH	Antimony monohydride	sbh
137	ND₂	Amidogen-d2	nd2
138	NH₂^-	amino anion	nh2-
139	NH₂⁺	Amino cation	nh2+
140	PH₂	Phosphino radical	ph2
141	PH₂^-	Phosphino anion	ph2-
142	PH₂⁺	Phosphino cation	ph2+
143	AsH₂	Arsenic dihydride	ash2
144	AsH₂⁺	Arsenic dihydride cation	ash2+
145	ND₃	Ammonia-d3	nd3
146	NH₃^-	Ammonia anion	nh3-
147	NH₃⁺	ammonia cation	nh3+
148	PH₃	Phosphine	ph3
149	AsH₃	Arsine	ash3
150	SbH₃	Stibine	sbh3
151	NH₄⁺	ammonium cation	nh4+
152	PH₄⁺	phosphonium cation	ph4+
153	O^-	Oxygen atom anion	o-
154	O⁺	Oxygen atom cation	o+
155	S⁺	Sulfur atom cation	s+
156	Cr	Chromium atom	cr
157	Te	Tellurium atom	te
158	Te⁺	Tellurium atom cation	te+
159	DO	Hydroxyl-d	od
160	DS	Mercapto-d	ds
161	HS	Mercapto radical	hs
162	HS^-	mercapto anion	sh-
163	HS⁺	sulfur monohydride cation	sh+
164	CrH	Chromium hydride	crh
165	CrH⁺	Chromium hydride cation	crh+
166	TeH	Telluryl radical	teh
167	D₂O	Deuterium oxide	d2o
168	H₂O⁺	water cation	h2o+
169	HDO	Water-d1	hdo
170	D₂S	Hydrogen sulfide-d2	d2s
171	H₂S^-	Hydrogen sulfide anion	h2s-
172	H₂S⁺	Hydrogen sulfide cation	h2s+
173	H₂Te	Hydrogen Telluride	h2te
174	H₃O⁺	hydronium cation	h3o+
175	H₃S⁺	Sulfonium cation	h3s+
176	F⁺	Fluorine atom cation	f+
177	Cl⁺	Chlorine atom cation	cl+
178	Mn	Manganese atom	mn
179	I	Iodine atom	iodine
180	I^-	Iodine atom anion	iodine-
181	I⁺	Iodine atom cation	iodine+
182	DF	Hydrofluoric acid-d	df
183	DCl	Hydrochloric acid-d	dcl
184	HI	Hydrogen iodide	hi
185	HI⁺	Hydrogen iodide cation	hi+
186	H₂F⁺	dihydrogen fluoride cation	h2f+
187	H₂Cl⁺	dihydrogen monochloride cation	h2cl+
188	H₂I⁺	Iodonium	h2i+
189	Ne	Neon atom	ne
190	Ne^-	Neon atom anion	ne-
191	Ne⁺	Neon atom cation	ne+
192	Ar	Argon atom	ar
193	Ar^-	Argon atom anion	ar-
194	Ar⁺	Argon atom cation	ar+
195	Fe	Iron atom	fe
196	Kr	Krypton atom	kr
197	Kr⁺	Krypton cation	kr+
198	Xe	Xenon atom	xe
199	NeH	neon hydrogen	neh
200	NeH⁺	neon hydrogen cation	neh+
201	KrH⁺	Protonated Krypton	krh+
202	XeH⁺	Xenon, protonated	xeh+
203	H₂Ar	H2 Ar dimer	h2ar
204	Co	Cobalt atom	cobalt
205	Ni	Nickel atom	ni
206	Li₂	Lithium diatomic	li2
207	Li₂^-	lithium diatomic anion	li2-
208	Li₂⁺	lithium diatomic cation	li2+
209	NaLi^-	lithium sodium anion	lina-
210	NaLi⁺	lithium sodium cation	lina+
211	LiK	Lithium Potassium	lik
212	Na₂⁺	sodium diatomic cation	na2+
213	NaK	Sodium Potassium	nak
214	NaK⁺	Sodium Potassium diatomic cation	nak+
215	K₂	Potassium diatomic	k2
216	Cu₂	Copper diatomic	cu2
217	LiBe	Lithium Beryllium	libe
218	LiMg	Lithium magnesium	limg
219	NaBe	Sodium Beryllium	nabe
220	NaMg	Sodium Magnesium	namg
221	Be₂	Beryllium diatomic	be2
222	Be₂^-	Beryllium diatomic anion	be2-
223	Be₂⁺	Beryllium diatomic cation	be2+
224	BeMg	Beryllium Magnesium	bemg
225	Mg₂	Magnesium diatomic	mg2
226	Mg₂^-	magnesium diatomic anion	mg2-
227	Mg₂⁺	magnesium diatomic cation	mg2+
228	Ca₂	Calcium diatomic	ca2
229	LiB	Lithium boride	lib
230	NaAl	Sodium aluminum	naal
231	BeB	Beryllium monoboride	beb
232	B₂	Boron diatomic	b2
233	B₂^-	Boron diatomic anion	b2-
234	B₂⁺	Boron diatomic cation	b2+
235	BAl	Boron Aluminum	bal
236	Al₂	Aluminum diatomic	al2
237	Al₂^-	aluminum diatomic anion	al2-
238	Al₂⁺	aluminum diatomic cation	al2+
239	BGa	Boron Gallium	bga
240	AlGa	Aluminum Gallium	alga
241	Ga₂	Gallium diatomic	ga2
242	LiBH₄	Lithium borohydride	libh4
243	HBHHBH	Diborane(4) C2V	hbhhbh
244	Al₂H₆	dialane	al2h6
245	Ga₂H₆	digallane	ga2h6
246	LiC	Lithium Carbide	lic
247	BeC	Beryllium Carbide	bec
248	CaC	Calcium monocarbide	cac
249	BC	boron monocarbide	bc
250	BC^-	boron monocarbide anion	bc-
251	BC⁺	boron monocarbide cation	bc+
252	AlC	Aluminum carbide	alc
253	BSi	Boron silicide	bsi
254	C₂	Carbon diatomic	c2
255	C₂^-	carbon diatomic anion	c2-
256	C₂⁺	carbon diatomic cation	c2+
257	SiC	silicon monocarbide	sic
258	SiC^-	silicon monocarbide anion	sic-
259	SiC⁺	silicon monocarbide cation	sic+
260	Si₂	Silicon diatomic	si2
261	Si₂^-	silcon diatomic anion	si2-
262	Si₂⁺	silcon diatomic cation	si2+
263	Ge₂	Germanium diatomic	ge2
264	C₂H	Ethynyl radical	c2h
265	C₂H⁺	Ethynyl cation	c2h+
266	ZnCH₂	Zinc methylene	znch2
267	C₂H₂	Acetylene	c2h2
268	CCH₂	vinylidene	vinylidene
269	H₂CC^-	vinylidene anion	h2cc-
270	HCCH^-	acetylene anion	c2h2-
271	CuCH₃	monomethyl copper	cuch3
272	ZnCH₃	Zinc monomethyl	znch3
273	CH₂BH	methyleneborane	ch2bh
274	C₂H₃	vinyl	c2h3
275	C₂H₃^-	vinyl anion	c2h3-
276	C₂H₄^-	Ethylene anion	c2h4-
277	C₂H₄⁺	Ethylene cation	c2h4+
278	CH₃CH	methylmethylene	ch3ch
279	CH₂SiH₂	silaethylene	ch2sih2
280	CH₃BH₂	methylborane	ch3bh2
281	C₂H₅	Ethyl radical	c2h5
282	C₂H₅^-	Ethyl anion	c2h5-
283	C₂H₅⁺	Ethyl cation	c2h5+
284	C₂H₆⁺	ethane cation	c2h6+
285	CH₃SiH₃	methyl silane	ch3sih3
286	GeH₃CH₃	methyl germane	geh3ch3
287	C₂H₇⁺	Ethane, protonated	c2h7+
288	LiN⁺	Lithium Nitride cation	lin+
289	BeN	Beryllium mononitride	ben
290	BeN^-	Beryllium mononitride anion	ben-
291	BeN⁺	Beryllium mononitride cation	ben+
292	BN^-	boron nitride anion	bn-
293	AlN^-	aluminum mononitride anion	aln-
294	AlN⁺	aluminum mononitride cation	aln+
295	BP	Boron monophosphide	bp
296	AlP	Aluminum monophosphide	alp
297	GaN	Gallium mononitride	gan
298	GaP	Gallium monophosphide	gap
299	BN	boron nitride	bn
300	BN⁺	boron nitride cation	bn+
301	AlN	Aluminum nitride	aln
302	CN^-	cyanide anion	cn-
303	CN⁺	Cyano cation	cn+
304	CP	Carbon monophosphide	cp
305	CP^-	carbon monophosphide anion	cp-
306	CP⁺	carbon monophosphide cation	cp+
307	SiN	Silicon nitride	sin
308	SiN^-	silicon mononitride anion	sin-
309	SiN⁺	silicon mononitride cation	sin+
310	SiP^-	Silicon monophosphide anion	sip-
311	SiP⁺	Silicon monophosphide cation	sip+
312	TiN	Titanium mononitride	tin
313	N₂⁺	diatomic nitrogen cation	n2+
314	PN^-	phosphorus nitride anion	pn-
315	PN⁺	phosphorus nitride cation	pn+
316	P₂	Phosphorus diatomic	p2
317	P₂^-	phosphorus diatomic anion	p2-
318	P₂⁺	phosphorus diatomic cation	p2+
319	AsN	Arsenic mononitride	asn
320	AsP	Arsenic monophosphide	asp
321	SbN	Antimony nitride	sbn
322	As₂	Arsenic diatomic	as2
323	HNB	hydrogen nitrogen boron	hnb
324	HNC	hydrogen isocyanide	hnc
325	HCN^-	Hydrogen cyanide anion	hcn-
326	HCN⁺	hydrogen cyanide cation	hcn+
327	HCP	Phosphaethyne	hcp
328	NNH	Dinitrogen monohydride	nnh
329	HPO	Hydrogen phosphorus oxide	hpo
330	HPO⁺	Hydrogen phosphorus oxide cation	hpo+
331	HBNH	Boranimine	hbnh
332	CNH₂	Aminomethylidyne radical	cnh2
333	CNH₂⁺	N-protonated hydrogen isocyanide	cnh2+
334	H₂CN	Dihydrogen cyanide radical	h2cn
335	H₂CN⁺	hydrocyanonium cation	h2cn+
336	HCNH	methyleneazane	hcnh
337	HCNH⁺	N-protonated HCN	hcnh+
338	N₂H₂	(E)-diazene	n2h2
339	N₂H₂	(Z)-Diazene	n2h2z
340	N₂H₂⁺	trans-diazene cation	n2h2+
341	CH₂PH	Phosphaethene	ch3p
342	CH₂NH₂⁺	methyleneamine cation	ch2nh2+
343	N₂H₄	Hydrazine	n2h4
344	N₂H₄⁺	hydrazine cation	n2h4+
345	P₂H₄	Diphosphine	p2h4
346	CH₃NH₂⁺	methyl amine cation	ch3nh2+
347	CH₃PH₂	Methyl phosphine	ch3ph2
348	N₂H₅⁺	protonated hydrazine	n2h5+
349	BH₃NH₃	borane ammonia	bh3nh3
350	CH₃NH₃	methyl ammonium radical	ch3nh3
351	CH₃NH₃⁺	protonated methylamine	ch3nh3+
352	CH₃PH₃⁺	methyl phosphine, protonated	ch3ph3+
353	NH₃NH₃	Ammonia Dimer	nh3nh3
354	N₂H₇⁺	ammonia ammonium dimer	n2h7+
355	LiO	lithium oxide	lio
356	LiO^-	lithium oxide anion	lio-
357	LiO⁺	lithium oxide cation	lio+
358	LiS	Lithium monosulfide	lis
359	LiS⁺	Lithium sulfide cation	lis+
360	NaO	sodium monoxide	nao
361	NaO^-	sodium oxide anion	nao-
362	NaO⁺	sodium oxide cation	nao+
363	KO	Potassium monoxide	ko
364	KO⁺	Potassium monoxide cation	ko+
365	NaS	Sodium sulfide	nas
366	CuO	Copper Monoxide	cuo
367	BeO	beryllium oxide	beo
368	BeO^-	Beryllium monoxide anion	beo-
369	BeO⁺	Beryllium monoxide cation	beo+
370	BeS	beryllium sulfide	bes
371	MgO	magnesium oxide	mgo
372	MgO^-	magnesium oxide anion	mgo-
373	MgO⁺	magnesium oxide cation	mgo+
374	CaO	Calcium monoxide	cao
375	MgS	magnesium sulfide	mgs
376	MgS^-	magnesium sulfide anion	mgs-
377	MgS⁺	magnesium sulfide cation	mgs+
378	CaS	Calcium sulfide	cas
379	ZnO	zinc monoxide	zno
380	ZnS	Zinc sulfide	zns
381	BeS^-	Beryllium monosulfide anion	bes-
382	BeS⁺	Beryllium monosulfide cation	bes+
383	BO	boron monoxide	bo
384	BO^-	boron monoxide anion	bo-
385	AlO	Aluminum monoxide	alo
386	AlO^-	Aluminum monoxide anion	alo-
387	AlO⁺	aluminum monoxide cation	alo+
388	BS	boron sulfide	bs
389	BS^-	boron monosulfide anion	bs-
390	BS⁺	boron monosulfide cation	bs+
391	AlS	Aluminum sulfide	als
392	AlS^-	aluminum monosulfide anion	als-
393	AlS⁺	aluminum monosulfide cation	als+
394	ScO	Scandium monoxide	sco
395	BO⁺	boron monoxide cation	bo+
396	CO^-	carbon monoxide anion	co-
397	CS	carbon monosulfide	cs
398	CS^-	carbon monosulfide anion	cs-
399	CS⁺	carbon monosulfide cation	cs+
400	SiO^-	silicon monoxide anion	sio-
401	SiO⁺	silicon monoxide cation	sio+
402	SiS^-	silicon monosulfide anion	sis-
403	SiS⁺	silicon monosulfide cation	sis+
404	TiO	Titanium monoxide	tio
405	CSe^-	Carbon monoselenide anion	cse-
406	CSe⁺	Carbon monoselenide cation	cse+
407	GeO⁺	Germanium monoxide cation	geo+
408	GeS	Germanium monosulfide	ges
409	NO⁺	nitric oxide cation	no+
410	NS	Mononitrogen monosulfide	ns
411	NS^-	nitrogen sulfide anion	ns-
412	NS⁺	nitrogen sulfide cation	ns+
413	PO	Phosphorus monoxide	po
414	PO^-	phosphorus monoxide anion	po-
415	PO⁺	phosphorus monoxide cation	po+
416	PS	phosphorus sulfide	ps
417	PS^-	phosphorus monosulfide anion	ps-
418	PS⁺	phosphorus monosulfide cation	ps+
419	VO	Vanadium monoxide	vo
420	AsO	Arsenic monoxide	aso
421	NSe	Nitrogen monoselenide	nse
422	AsS	Arsenic monosulfide	ass
423	PSe	Phosphorus monoselenide	pse
424	AsSe	Arsenic monoselenide	asse
425	O₂⁺	diatomic oxygen cation	o2+
426	SO^-	sulfur monoxide anion	so-
427	S₂^-	sulfur diatomic anion	s2-
428	S₂⁺	sulfur diatomic cation	s2+
429	SeO^-	selenium monoxide anion	seo-
430	SeO⁺	selenium monoxide cation	seo+
431	SeS	Selenium monosulfide	ses
432	SeS^-	selenium monosulfide anion	ses-
433	SeS⁺	selenium monosulfide cation	ses+
434	TeO	Tellurium monoxide	teo
435	Se₂^-	selenium diatomic anion	se2-
436	Se₂⁺	selenium diatomic cation	se2+
437	Te₂	Tellurium diatomic	te2
438	LiOH	lithium hydroxide	lioh
439	NaOH	sodium hydroxide	naoh
440	KOH	Potassium hydroxide	koh
441	MgOH	magnesium hydroxide	mgoh
442	CaOH	Calcium monohydroxide	caoh
443	HBO	Boron hydride oxide	hbo
444	COH⁺	Carbon Monoxide, protonated	coh+
445	HCO^-	formyl anion	hco-
446	HCS	Thioformyl radical	hcs
447	HCS^-	Thioformyl anion	hcs-
448	HCS⁺	Thioformyl cation	hcs+
449	HNO^-	Nitrosyl hydride anion	hno-
450	NOH	Hydroxyimidogen	noh
451	NOH⁺	O-protonated nitric oxide	noh+
452	HNS	Sulfur imide	hns
453	HNS^-	Sulfur imide anion	hns-
454	HO₂	Hydroperoxy radical	ho2
455	HO₂^-	Hydroperoxy anion	ho2-
456	HO₂⁺	Hydroperoxy cation	ho2+
457	HS₂	Thiosulfeno radical	hs2
458	HOCH	hydroxycarbene	hoch
459	H₂CS^-	thioformaldehyde anion	h2cs-
460	H₂CS⁺	thioformaldehyde cation	h2cs+
461	H₂NO	nitroxide	h2no
462	H₂O₂⁺	Hydrogen peroxide cation	h2o2+
463	H₂S₂	Disulfane	h2s2
464	H₂S₂⁺	hydrogen disulfide cation	h2s2+
465	CH₂OH	Hydroxymethyl radical	ch2oh
466	CH₂OH⁺	hydroxymethyl cation	ch2oh+
467	CH₃O	Methoxy radical	ch3o
468	CH₃O^-	methoxy anion	ch3o-
469	CH₃O⁺	Methoxy cation	ch3o+
470	CH₃S	thiomethoxy	ch3s
471	H₂CSH⁺	Thioformaldehyde, protonated	h2csh+
472	NH₃O	Ammonia Oxide	nh3o
473	H₂POH	Phosphinous acid	h2poh
474	H₃PO	Phosphine oxide	h3po
475	NH₂SH	Thiohydroxylamine	nh2sh
476	NH₃S	sulfidoazane	nh3s
477	H₃O₂⁺	hydrogen peroxide, protonated	h3o2+
478	CH₃OH^-	Methyl alcohol anion	ch3oh-
479	CH₃SH	Methanethiol	ch3sh
480	CH₃SH⁺	Methanethiol cation	ch3sh+
481	CH₃SeH	Methane selenol	ch3seh
482	H₂OH₂O	water dimer	h2oh2o
483	CH₃OH₂⁺	Methanol, protonated	ch3oh2+
484	CH₃SH₂⁺	protonated methylsulfide	ch3sh2+
485	H₂ONH₃	Water Ammonia Dimer	h2onh3
486	H₅O₂⁺	Dihydroxonium ion	h5o2+
487	LiCl^-	lithium chloride anion	licl-
488	LiCl⁺	lithium chloride cation	licl+
489	NaF	sodium fluoride	naf
490	NaF^-	sodium fluoride anion	naf-
491	KF	Potassium Fluoride	kf
492	NaCl	Sodium Chloride	nacl
493	NaCl^-	sodium chloride anion	nacl-
494	NaCl⁺	sodium chloride cation	nacl+
495	KCl	Potassium Chloride	kcl
496	CuF	Copper monofluoride	cuf
497	LiBr^-	lithium bromide anion	libr-
498	LiBr⁺	lithium bromide cation	libr+
499	CuCl	Copper monochloride	cucl
500	NaBr	Sodium Bromide	nabr
501	NaBr^-	sodium bromide anion	nabr-
502	NaBr⁺	sodium bromide cation	nabr+
503	KBr	Potassium Bromide	kbr
504	LiI	Lithium Iodide	lii
505	NaI	Sodium Iodide	nai
506	KI	Potassium Iodide	ki
507	LiF^-	lithium fluoride anion	lif-
508	BeF	Beryllium monofluoride	bef
509	BeF^-	Beryllium monofluoride anion	bef-
510	BeF⁺	Beryllium monofluoride cation	bef+
511	BeCl	beryllium monochloride	becl
512	MgF	Magnesium monofluoride	mgf
513	MgF^-	magnesium fluoride anion	mgf-
514	MgF⁺	magnesium fluoride cation	mgf+
515	CaF	Calcium monofluoride	caf
516	MgCl	magnesium monochloride	mgcl
517	MgCl^-	magnesium monochloride anion	mgcl-
518	MgCl⁺	magnesium monochloride cation	mgcl+
519	CaCl	calcium monochloride	cacl
520	TiCl	Titanium Monochloride	ticl
521	ZnF	Zinc monofluoride	znf
522	ZnF^-	Zinc monofluoride anion	znf-
523	ZnF⁺	Zinc monofluoride cation	znf+
524	ZnCl	Zinc monochloride	zncl
525	CaBr	Calcium monobromide	cabr
526	BeCl^-	beryllium monochloride anion	becl-
527	BeCl⁺	beryllium monochloride cation	becl+
528	BF^-	Boron monofluoride anion	bf-
529	BF⁺	Boron monofluoride cation	bf+
530	AlF^-	Aluminum monofluoride anion	alf-
531	AlF⁺	Aluminum monofluoride cation	alf+
532	BCl	boron monochloride	bcl
533	BCl^-	boron monochloride anion	bcl-
534	BCl⁺	boron monochloride cation	bcl+
535	AlCl	Aluminum monochloride	alcl
536	AlCl^-	aluminum monochloride anion	alcl-
537	AlCl⁺	aluminum monochloride cation	alcl+
538	ScF	Scandium monofluoride	scf
539	BBr	Boron monobromide	bbr
540	GaF⁺	Gallium monofluoride cation	gaf+
541	GaCl⁺	Gallium monochloride cation	gacl+
542	AlI	Aluminum monoiodide	ali
543	CF^-	carbon monofluoride anion	cf-
544	CF⁺	carbon monofluoride cation	cf+
545	CCl	carbon monochloride	ccl
546	CCl^-	carbon monochloride anion	ccl-
547	CCl⁺	carbon monochloride cation	ccl+
548	SiF	silicon monofluoride	sif
549	SiF^-	silicon monofluoride anion	sif-
550	SiF⁺	silicon monofluoride cation	sif+
551	SiCl^-	silicon monochloride anion	sicl-
552	SiCl⁺	silicon monochloride cation	sicl+
553	CBr	Carbon monobromide	cbr
554	GeF⁺	Germanium monofluoride cation	gef+
555	SiBr	Silicon monobromide	sibr
556	NF	nitrogen fluoride	nf
557	NF^-	nitrogen monofluorine anion	nf-
558	NF⁺	nitrogen monofluoirde cation	nf+
559	NCl	nitrogen monochloride	ncl
560	NCl^-	nitrogen monochloride anion	ncl-
561	NCl⁺	nitrogen monochloride cation	ncl+
562	PF	phosphorus monofluoride	pf
563	PF^-	phosphorus monofluoride anion	pf-
564	PF⁺	phosphorus monofluoride cation	pf+
565	PCl	phosphorus chloride	pcl
566	PCl^-	phosphorus monochloride anion	pcl-
567	PCl⁺	phosphorus monochloride cation	pcl+
568	AsF	Arsenic monofluoride	asf
569	NBr	nitrogen monobromide	nbr
570	AsCl	Arsenic monochloride	ascl
571	SbF	Antimony monofluoride	sbf
572	SbCl	Antimony monochloride	sbcl
573	FO	Oxygen monofluoride	fo
574	FO^-	flourine oxide anion	fo-
575	FO⁺	fluorine monoxide cation	fo+
576	ClO^-	chlorine monoxide anion	clo-
577	SF^-	sulfur monofluoride anion	sf-
578	SCl	sulfur monochloride	scl
579	SCl^-	sulfur monochloride anion	scl-
580	BrO^-	Bromine monoxide anion	bro-
581	SeF	Selenium monofluoride	sef
582	SeCl	Selenium monochloride	secl
583	IO	Iodine monoxide	io
584	ClF	Chlorine monofluoride	clf
585	ClF^-	clorine monofluoride anion	clf-
586	Cl₂^-	chlorine diatomic anion	cl2-
587	BrF^-	bromine fluoride anion	brf-
588	BrF⁺	bromine fluoride cation	brf+
589	BrCl^-	bromine chloride anion	brcl-
590	BrCl⁺	bromine chloride cation	brcl+
591	IF	Iodine monofluoride	if
592	ICl	Iodine monochloride	icl
593	IBr	Iodine monobromide	ibr
594	I₂	Iodine diatomic	i2
595	I₂⁺	Iodine diatomic cation	i2+
596	HCCl	Chloromethylene	hccl
597	CHBr	bromomethylene	chbr
598	DOCl	Hypochlorous acid-d	docl
599	HOBr	Hypobromous acid	hobr
600	HOBr⁺	Hypobromous acid cation	hobr+
601	HOI	Hypoiodous acid	hoi
602	F₂H⁺	Fluorine, protonated	f2h+
603	FHF	Hydrogen difluoride	fhf
604	FHF^-	Hydrogen difluoride anion	fhf-
605	Cl₂H⁺	Chlorine, protonated	cl2h+
606	CH₂F	fluoromethyl radical	ch2f
607	NH₂F	monofluoroamine	nh2f
608	H₂F₂	Hydrogen fluoride dimer	h2f2
609	CD₃F	methylfluoride-d3	cd3f
610	CD₃Cl	methyl chloride d3	cd3cl
611	CH₃Cl⁺	Methyl chloride cation	ch3cl+
612	SiH₃Br	bromosilane	sih3br
613	CH₃I	methyl iodide	ch3i
614	SiH₃I	Silyl Iodide	sih3i
615	CH₃ClH⁺	methyl chloride, protonated	ch3clh+
616	LiNe⁺	Lithium Neon cation	line+
617	Ne₂	Neon diatomic	ne2
618	Ne₂⁺	Neon diatomic cation	ne2+
619	Ar₂⁺	Argon diatomic cation	ar2+
620	Li₃	Lithium trimer	li3
621	Li₃⁺	Lithium trimer cation	li3+
622	C₃	carbon trimer	c3
623	C₃⁺	carbon trimer cation	c3+
624	C₃H₃	cyclopropenyl radical	cpr
625	C₃H₃	Propargyl radical	propargyl
626	C₃H₃^-	Propargyl anion	c3h3-
627	C₃H₃⁺	cyclopropenyl cation	cpr+
628	C₃H₃⁺	Propargyl cation	c3h3+
629	C₃H₅	Allyl radical	allyl
630	C₃H₅⁺	Allyl cation	allyl+
631	CH₃CHCH	1-propenyl radical	ch3chch
632	Zn(CH₃)₂	dimethyl zinc	dmz
633	C₃H₆	Cyclopropane	c3h6
634	C₃H₇⁺	cyclopropane, protonated	c3h7+
635	CH₃CHCH₃	Isopropyl radical	isopropyl
636	CH₃CHCH₃⁺	Isopropyl cation	prop2yl+
637	C₃H₈	Propane	propane
638	SiH₂(CH₃)₂	dimethylsilane	dms
639	LiCN	lithium cyanide	licn
640	NaCN	Sodium Cyanide	nacn
641	KCN	Potassium cyanide	kcn
642	CuCN	Copper cyanide	cucn
643	ZnCN	Zinc monocyanide	zncn
644	ZnNC	Zinc isocyanide	znnc
645	CN₂	3H-Diazirin-3-ylidene	cn2
646	NCN	Cyanoimidogen	ncn
647	N₃	azide radical	n3
648	N₃^-	azide anion	n3-
649	N₃⁺	azide cation	n3+
650	HCCN	cyanomethylene	hccn
651	HCNN	diazomethyl radical	hcnn
652	CH₂N₂	diazirine	ch2n2
653	CH₂NN	diazomethane	ch2nn
654	NH₂CN	cyanamide	cyanamide
655	CH₃CN⁺	Acetonitrile cation	ch3cn+
656	CH₃NC	methyl isocyanide	ch3nc
657	CHNCH₂	2H-Azirine	c157164
658	CHNHCH	1H-Azirine	chnhch
659	H₂CCNH	Ethenimine	ch2cnh
660	H₂CNCH	methyleneaminomethylene	ch2nch
661	HCCNH₂	Ethynamine	hccnh2
662	HNCNH₂⁺	diiminomethane, protonated	hncnh2+
663	NCNH₃⁺	Cyanamide, protonated	ncnh3+
664	CH₂CHNH	vinylazine	ch2chnh
665	CH₃CHN	methylmethaniminyl radical	ch3chn
666	NHCHNH₂	aminomethanimine	cn2h4
667	C₂H₅N	Aziridine	c2h5n
668	CH₂CHNH₂	aminoethene	aminoethene
669	CH₂NCH₃	N-methylmethanimine	nmm
670	CH₃CHNH	ethanimine	ethanimine
671	NH₂BHNH₂	diaminoborane	nh2bhnh2
672	C₂H₅NH⁺	Protonated Aziridine	c2h5nh+
673	C₂H₆N⁺	aziridine, protonated	c2h6n+
674	NH₂CH₂NH₂	diaminomethane	nh2ch2nh2
675	CH₃CH₂NH₂	Ethylamine	etam
676	CH₃NHCH₃	Dimethylamine	ch3nhch3
677	CH₃PHCH₃	dimethylphosphine	ch3phch3
678	NH₂CH₂NH₃⁺	diaminoethane, protonated	pdam
679	(CH₃)₂NH₂⁺	dimethylammonium cation	dmam
680	CH₃CH₂NH₃⁺	ethylamine, protonated	pea
681	Li₂O	dilithium oxide	li2o
682	Li₂O⁺	dilithium oxide cation	li2o+
683	Li₂S	dilithium sulfide	li2s
684	Na₂O	disodium monoxide	na2o
685	CCO	Dicarbon monoxide	cco
686	CNO^-	fulminate	cno-
687	NCO	isocyanato radical	nco
688	NCO^-	cyanate	nco-
689	SCN	thiocyanato radical	scn
690	SCN^-	thiocyanide anion	scn-
691	BO₂	Boron dioxide	bo2
692	BO₂^-	Boron dioxide anion	bo2-
693	BO₂⁺	Boron dioxide cation	bo2+
694	N₂O^-	Nitrous oxide anion	n2o-
695	N₂O⁺	Nitrous oxide cation	n2o+
696	NNS	Nitrogen sulfide	nns
697	PPO	Phosphorus oxide phosphide	ppo
698	CO₂^-	Carbon dioxide anion	co2-
699	CO₂⁺	Carbon dioxide cation	co2+
700	OCS⁺	Carbonyl sulfide cation	cos+
701	SiO₂	silicon dioxide	sio2
702	CS₂^-	Carbon disulfide anion	cs2-
703	CS₂⁺	Carbon disulfide cation	cs2+
704	TiO₂	Titanium dioxide	tio2
705	SiS₂	Silicon disulfide	sis2
706	GeS₂	Germanium disulfide	ges2
707	CSe₂	Carbon diselenide	cse2
708	SCTe	Carbon sulfide Telluride	scte
709	NO₂	Nitrogen dioxide	no2
710	NO₂^-	Nitrogen dioxide anion	no2-
711	NO₂⁺	Nitrogen dioxide cation	no2+
712	PO₂	Phosphorus dioxide	po2
713	PO₂^-	Phosphorus dioxide anion	po2-
714	PO₂⁺	Phosphorus dioxide cation	po2+
715	AsO₂	Aresenic dioxide	aso2
716	O₃	Ozone	o3
717	O₃^-	Ozone anion	o3-
718	O₃⁺	Ozone cation	o3+
719	SO₂^-	Sulfur dioxide anion	so2-
720	SO₂⁺	Sulfur dioxide cation	so2+
721	S₃^-	Sulfur trimer anion	s3-
722	S₃⁺	Sulfur trimer cation	s3+
723	SeO₂⁺	Selenium dioxide cation	seo2+
724	TeO₂	Tellurium Dioxide	teo2
725	CS₂H⁺	Carbon disulfide, protonated	cs2h+
726	HNCO	Isocyanic acid	hnco
727	HOCN	cyanic acid	hocn
728	HNCS	Isothiocyanic acid	hncs
729	HSCN	thiocyanic acid	hscn
730	HCO₂^-	formate anion	hco2-
731	HNNO	nitrosoazane	hnno
732	HNNO⁺	Nitrous oxide, N-protonated	hnno+
733	NNOH⁺	Nitrous Oxide, O-protonated	nnoh+
734	HCOO	formate neutral radical	hcoo
735	HOCO⁺	Hydrocarboxyl cation	hoco+
736	HNO₂	Nitrous acid	hno2
737	HNO₂⁺	nitrous acid cation	hno2+
738	SO₂H⁺	protonated sulfur dioxide	so2h+
739	CH₂CO⁺	Ketene cation	ch2co+
740	HCCOH	ethynol	hccoh
741	Be(OH)₂	Beryllium hydroxide	beo2h2
742	Mg(OH)₂	Magnesium dihydroxide	h2mgo2
743	NH₂NO	Nitrosamide	nh2no
744	CH₂O₂	Dioxirane	diox
745	H₂COO	Dioxymethyl radical	h2coo
746	H₂COO⁺	dioxymethyl cation	h2coo+
747	H₂O₃	Hydrogen trioxide	h2o3
748	HSSSH	trisulfane	hsssh
749	NaOCH₃	Sodium methoxide	naoch3
750	CH₂BOH	hydroxy(methylene)borane	ch2boh
751	CH₃BO	Borane, methyloxo-	ch3bo
752	CH₂CHO	Vinyloxy radical	ch2cho
753	CH₂COH⁺	ketene, protonated	ch2coh+
754	CH₃CO	Acetyl radical	ch3co
755	CH₃CO^-	Acetyl anion	ch3co-
756	CH₃CO⁺	acetyl cation	ch3co+
757	CH₂NOH	formaldoxime	ch2noh
758	CH₃NO	nitrosomethane	ch3no
759	CHONH₂	formamide	formamide
760	CNOH₃	1,2-oxaziridine	cnoh3
761	HOCHNH	hydroxymethylimine	hochnh
762	CHSNH₂	thioformamide	chsnh2
763	CH₂OOH	CH2OOH radical	ch2ooh
764	CH₃OO	methylperoxy radical	ch3oo
765	CH₃OO^-	methylperoxy anion	ch3oo-
766	CH₃OO⁺	methylperoxy cation	ch3oo+
767	CH₂CHOH	ethenol	ch2choh
768	CH₂CHSH	Ethenethiol	ch2chsh
769	H₂CONH₂⁺	protonated formamide	h2conh2+
770	NH₃CHO⁺	Formamide, N-Protonated	nh3cho+
771	CH₂(OH)₂	methanediol	ch2o2h2
772	CH₃OOH	Methyl peroxide	ch3ooh
773	H₂OH₂CO	water formaldehyde dimer	h2oh2co
774	C₂H₄OH⁺	ethylene oxide, protonated	c2h4oh+
775	CH₂CH₂OH	2-hydroxy ethyl radical	ch2ch2oh
776	CH₃CH₂O	Ethoxy radical	ethoxy
777	CH₃CHOH	1-hydroxy-ethyl radical	ch3choh
778	CH₃CHOH⁺	acetaldehyde, protonated	ch3choh+
779	CH₃OCH₂	methoxymethyl radical	ch3och2
780	NH₂CH₂OH	aminomethanol	nh2ch2oh
781	CH₃CH₂OH	Ethanol	etoh
782	CH₃OCH₃	Dimethyl ether	meome
783	CH₃SCH₃⁺	dimethyl sulfide cation	mesme+
784	CH₃SeCH₃	dimethylselenide	dmse
785	CH₃OHH₂O	methanol water dimer	ch3ohh2o
786	H₂OCH₃OH	water methanol dimer	h2och3oh
787	CuF₂	Copper difluoride	cuf2
788	ZnF₂	Zinc difluoride	znf2
789	CNF	iso cyanogen fluoride	cnf
790	FCN	Cyanogen fluoride	fcn
791	ClCN	chlorocyanogen	clcn
792	ICN	Cyanogen iodide	icn
793	BeF₂	Beryllium fluoride	bef2
794	MgF₂	Magnesium fluoride	mgf2
795	BeCl₂	Beryllium chloride	becl2
796	MgCl₂	Magnesium dichloride	mgcl2
797	CaCl₂	Calcium Chloride	cacl2
798	ZnCl₂	Zinc dichloride	zncl2
799	CaBr₂	Calcium dibromide	cabr2
800	CaF₂	Calcium difluoride	caf2
801	FCO	Carbonyl fluoride	fco
802	FCO⁺	Carbonyl fluoride cation	fco+
803	ClCO	carbonyl monochloride	clco
804	BF₂	Boron difluoride radical	bf2
805	FNS	Thionitrosyl fluoride	fns
806	FSN	Thiazyl fluoride	fsn
807	OPCl	Phosphorus oxychloride	opcl
808	BrNO	Nitrosyl bromide	brno
809	INO	Nitrosyl iodide	ino
810	CF₂^-	Difluoromethylene anion	cf2-
811	CF₂⁺	Difluoromethylene cation	cf2+
812	CFCl	chlorofluoromethylene	cfcl
813	SiF₂⁺	Silicon difluoride cation	sif2+
814	CCl₂	dichloromethylene	ccl2
815	CCl₂^-	dichloromethylene anion	ccl2-
816	CCl₂⁺	dichloromethylene cation	ccl2+
817	SiCl₂	Dichlorosilylene	sicl2
818	GeF₂	Germanium difluoride	gef2
819	CBr₂	dibromomethylene	cbr2
820	FOO	Dioxygen monofluoride radical	foo
821	ClOO	chloroperoxy radical	cloo
822	ClOO⁺	chloroperoxy cation	cloo+
823	OClO^-	Chlorine dioxide anion	oclo-
824	OClO⁺	Chlorine dioxide cation	oclo+
825	ClSO	Sulfur chloride oxide	clso
826	ClS₂	Sulfur chloride	cls2
827	NF₂	Difluoroamino radical	nf2
828	NF₂⁺	Difluoroamino cation	nf2+
829	FClO	chlorosyl fluoride	fclo
830	F₂O	Difluorine monoxide	f2o
831	ClOF	Chlorine hypofluorite	clof
832	SF₂^-	sulfur difluoride anion	sf2-
833	SF₂⁺	sulfur difluoride cation	sf2+
834	Cl₂O	Dichlorine monoxide	cl2o
835	SCl₂	Sulfur dichloride	scl2
836	BrOCl	Bromine hypochlorite	brocl
837	BrOBr	Bromine oxide	brobr
838	F₃^-	trifluoride anion	f3-
839	Cl₃^-	trichloride anion	cl3-
840	I₃^-	triiodide	i3-
841	HCCF⁺	fluoroacetylene cation	hccf+
842	HCCCl	Chloroacetylene	hcccl
843	HCCBr	bromoacetylene	hccbr
844	HFCO	formyl fluoride	hfco
845	HFCO⁺	formyl fluoride cation	hfco+
846	COHCl	Formyl chloride	cohcl
847	COHBr	Formyl bromide	cohbr
848	BHF₂	Difluoroborane	bhf2
849	BHCl₂	Borane, dichloro-	bhcl2
850	CHCl₂	dichloromethyl radical	chcl2
851	CHBr₂	dibromomethyl radical	chbr2
852	HOClO	Chlorous acid	hoclo
853	CH₂FCl	fluorochloromethane	ch2fcl
854	CH₂BrF	Methane, bromofluoro-	ch2fbr
855	CH₂BrCl	Methane, bromochloro-	ch2clbr
856	CH₂FI	fluoroiodomethane	ch2fi
857	CH₂ClI	chloroiodomethane	ch2cli
858	CH₂BrI	bromoiodomethane	ch2bri
859	CH₂I₂	Diiodomethane	ch2i2
860	SiH₂Cl₂	dichlorosilane	sih2cl2
861	CH₂CHF⁺	fluoroethene cation	ch2chf+
862	C₂H₃Cl	Ethene, chloro-	ch2chcl
863	C₂H₃Br	vinyl bromide	c2h3br
864	C₂H₃I	Vinyl iodide	c2h3i
865	CH₃OCl	methyl hypochlorite	ch3ocl
866	CH₂CH₂Cl	2-chloroethyl radical	ch2ch2cl
867	CHClCH₃	1-chloroethyl radical	chclch3
868	C₂H₅F	fluoroethane	c2h5f
869	CH₃CH₂Cl	Ethyl chloride	c2h5cl
870	CH₃SiFH₂	fluoromethylsilane	ch3sifh2
871	C₂H₅Br	Ethyl bromide	etbr
872	C₂H₅I	Ethyl iodide	c2h5i
873	KrF₂	Krypton difluoride	krf2
874	XeF₂	Xenon difluoride	xef2
875	B₄H₁₀	Tetraborane(10)	b4h10
876	C₄⁺	Carbon tetramer cation	c4+
877	C₄H₂	Diacetylene	c4h2
878	C₂H₃CCH	1-Buten-3-yne	c2h3cch
879	C₄H₄	cyclobutadiene	cbd
880	H₂CCCCH₂	Butatriene	h2cccch2
881	C₄H₆	1-Methylcyclopropene	c3100047
882	C₄H₆	Cyclobutene	c822355
883	C₄H₆	Methylenecyclopropane	c6142730
884	CH₂CCHCH₃	1,2-Butadiene	butad12
885	CH₂CHCHCH₂	1,3-Butadiene	c106990
886	CH₃CCCH₃	2-Butyne	c503173
887	CHCCH₂CH₃	1-Butyne	c107006
888	CH₃CHCHCH₂	methylallyl radical	c4h7
889	C₄H₈	methylcyclopropane	mcp
890	CH₂C(CH₃)CH₃	1-Propene, 2-methyl-	isobute
891	CH₂CHCH₂CH₃	1-Butene	bute1
892	CH₃CHCHCH₃	2-Butene, (E)-	bute2e
893	CH₃CHCHCH₃	2-Butene, (Z)-	bute2z
894	B(CH₃)₃	trimethylborane	bme3
895	Al(CH₃)₃	trimethyl aluminum	tma
896	C(CH₃)₃	Tert-butyl radical	tbutyl
897	CH₂CH(CH₃)₂	Isobutyl radical	isobutyl
898	CH₃CHCH₂CH₃	2-Butyl radical	butyl2
899	CH₃CH(CH₃)CH₃	Isobutane	isobutane
900	CH₃CH₂CH₂CH₃	Butane	butane
901	SiH(CH₃)₃	trimethylsilane	trimsi
902	Li₃N	trilithium nitride	li3n
903	C₂N₂	Cyanogen	c2n2
904	C₂N₂⁺	Cyanogen cation	c2n2+
905	P₄	Phosphorus tetramer	p4
906	As₄	Arsenic tetramer	as4
907	HCCCN	Cyanoacetylene	hcccn
908	HCCCN⁺	Cyanoacetylene cation	hcccn+
909	C₃H₃N	acrylonitrile	ch2chcn
910	C₃H₃N⁺	acrylonitrile cation	ch2chcn+
911	CH₃N₃	methyl azide	ch3n3
912	NH₂CCNH₂	Diaminoacetylene	daa
913	NH₂CH₂CN	Aminoacetonitrile	aan
914	CH₃NHN₂⁺	methyl azide, protonated	ch3nhn2+
915	C₂H₅CN	ethyl cyanide	c2h5cn
916	CH₅N₃	Guanidine	guanidine
917	C₄H₆	Bicyclo[1.1.0]butane	c157335
918	CH₃NNCH₃	(Z)-1,2-Dimethyldiazene	dmdiazz
919	CH₆N₃⁺	guanidinium	ch6n3+
920	C₃H₇N	Cyclopropylamine	cpram
921	CH₇N₃	triaminomethane	tam
922	C₃H₇N	Azetidine	azet
923	C₄H₈	cyclobutane	cbutane
924	C₂H₈N₂	Ethylenediamine	ethdiam
925	CH₃NHNHCH₃	dimethyl hydrazine	dmh
926	CH₃CH(NH₂)CH₃	2-Propanamine	pram2
927	N(CH₃)₃	Trimethylamine	trimeam
928	NH₂CH₂CH₂CH₃	1-Propanamine	pram1
929	P(CH₃)₃	trimethylphosphine	tmp
930	N(SiH₃)₃	trisilylamine	tsa
931	As(CH₃)₃	trimethyl arsine	tmas
932	(CH₃)₃NH⁺	protonated trimethyl amine	ptma
933	C₃H₇NH₃⁺	n-propylamine, protonated	c3h7nh2
934	Li₂O₂	dilithium dioxide	li2o2
935	Na₂O₂	disodium dioxide	na2o2
936	K₂O₂	dipotassium dioxide	k2o2
937	C₃O	Tricarbon monoxide	c3o
938	B₂O₂	Diboron dioxide	b2o2
939	S₂N₂	Disulfur dinitride	s2n2
940	CO₃	Carbon trioxide	co3
941	CO₃^--	carbonate	co3--
942	CS₃^--	Carbonotrithioate	cs3--
943	NO₃	Nitrogen trioxide	no3
944	NO₃^-	nitrate anion	no3-
945	NO₃⁺	nitrogen trioxide cation	no3+
946	SO₃^-	Sulfur trioxide anion	so3-
947	SO₃⁺	Sulfur trioxide cation	so3+
948	SeO₃	selenium trioxide	seo3
949	TeO₃	Tellurium trioxide	teo3
950	HCO₃^-	bicarbonate anion	hco3-
951	HSO₃	Hydroxysulfonyl radical	hso3
952	NH₂NO₂	nitramide	nh2no2
953	C₂H₂CO	cyclopropenone	c2h2co
954	HCCCHO	2-propynal	hcccho
955	C₂H₂O₂⁺	Ethanedial cation	c2h2o2+
956	H₂CO₃	Carbonic acid	h2co3
957	H₂CS₃	thiocarbonic acid	h2cs3
958	H₂NO₃⁺	Nitric Acid, Protonated	h2no3+
959	H₂SO₃	Sulfurous acid	h2so3
960	C₂H₃NO	Nitrosoethylene	c2h3no
961	HOCH₂CN	cyanomethanol	hoch2cn
962	CH₃COO^-	acetate anion	ch3coo-
963	CH₃NO₂	Methane, nitro-	ch3no2
964	CH₃ONO	Methyl nitrite	ch3ono
965	NH₂COOH	Carbamic acid	nh2cooh
966	H₃BO₃	Boric acid	h3bo3
967	H₃CO₃⁺	carbonic acid, protonated	h3co3+
968	C₃H₄O	2-Propyn-1-ol	c107197
969	C₃H₄O	allenol	c9000071
970	C₃H₄O	Cyclopropanone	cpone
971	C₃H₄O	Methylketene	c6004440
972	NH₂CONH₂	Urea	urea
973	NH₂CONH₂⁺	Urea cation	urea+
974	NH₂CSNH₂	Thiourea	thiourea
975	C₂H₄O₂	1,3-dioxetane	c2h4o2
976	CH₃COOH	Acetic acid	ch3cooh
977	CH₃OCHO	methyl formate	ch3ocho
978	CHOCH₂OH	hydroxy acetaldehyde	haa
979	NH₂COOH₂⁺	Carbamic acid, O-protonated	nh2cooh2+
980	NH₃COOH⁺	protonated Carbamic acid	nh3cooh+
981	H₂OHCOOH	Water formic acid dimer 1	h2ohcooh_10
982	H₂OHCOOH	Water formic acid dimer 2	h2ohcooh_11
983	HCOOHH₂O	Formic acid water dimer	hcoohh2o
984	HOCH₂OOH	hydroxy methyl peroxide	hoch2ooh
985	CH₃COCH₂	Acetonyl radical	ch3coch2
986	CH₃CHNOH	Acetaldoxime	acetaldoxime
987	CH₃CONH₂	Acetamide	acetamide
988	HCONHCH₃	N-methylformamide	nmfa
989	CH₅N₂O⁺	urea, N-protonated	ch4n2o+
990	H₂NCOHNH₂⁺	urea, protonated	ureah+
991	C₂H₅OO	ethylperoxy radical	c2h5oo
992	CH₃NNCH₃	(E)-1,2-Dimethyldiazene	dmdiaze
993	C₃H₅OH	Cyclopropanol	cproh
994	C₃H₆O	2-Propen-1-ol	c107186
995	C₃H₆O	Acetone enol	enol
996	C₃H₆O	Oxetane	oxetane
997	C₃H₆O	Propylene oxide	prox
998	CH₃COCH₃	Acetone	acetone
999	CH₃COCH₃^-	acetone anion	ch3coch3-
1000	C₃H₆S	Thietane	thietane
1001	C₃H₆S	Thiirane, methyl-	methiirane
1002	CH₃CSCH₃	Thioacetone	ch3csch3
1003	C₂H₆O₂	1,2-Ethanediol	ethdiol
1004	CH₃OOCH₃	dimethylperoxide	dmp
1005	CH₃SOCH₃	Dimethyl sulfoxide	dmso
1006	CH₂SHCH₂SH	1,2-Ethanedithiol	ethdisl
1007	CH₃SSCH₃	Disulfide, dimethyl	ch3ssch3
1008	CH₃COHCH₃⁺	acetone, protonated	acetoneh+
1009	HOCH₂CH₂NH₂	monoethanolamine	mea
1010	C₃H₇OH	1-Propanol	proh
1011	CH₃CHOHCH₃	Isopropyl alcohol	isoproh
1012	CH₃OC₂H₅	Ethane, methoxy-	etome
1013	C₃H₇SH	1-Propanethiol	prsh
1014	CH₃CHSHCH₃	2-Propanethiol	isoprsh
1015	CH₃SCH₂CH₃	Ethane, (methylthio)-	etsme
1016	H₂OCH₃OCH₃	water dimethylether dimer	h2och3och3
1017	Na₂F₂	Sodium Fluoride Dimer	na2f2
1018	Na₂Cl₂	Disodium dichloride	na2cl2
1019	C₂F₂	difluoroacetylene	c2f2
1020	C₂Cl₂	dichloroacetylene	c2cl2
1021	C₂Cl₂⁺	dichloroacetylene cation	c2cl2+
1022	FNO₂	Nitryl fluoride	fno2
1023	FONO	Nitrosyl hypofluorite	fono
1024	ClNO₂	Nitryl chloride	clno2
1025	ClONO	chlorine nitrite	clono
1026	BrONO	Bromine nitrite	brono
1027	N₂F₂	(Z)-Difluorodiazene	n2f2_z
1028	N₂F₂	Dinitrogen difluoride, (E)-	n2f2_e
1029	COFCl	Carbonic chloride fluoride	cofcl
1030	CCl₂O	Phosgene	cl2co
1031	Cl₂CS	Thiophosgene	cl2cs
1032	COBr₂	Carbonic dibromide	cobr2
1033	BF₃	Borane, trifluoro-	bf3
1034	BF₃^-	Borane, trifluoro- anion	bf3-
1035	AlF₃	Aluminum trifluoride	alf3
1036	BClF₂	Chlorodifluoroborane	bclf2
1037	AlF₂Cl	Aluminum chloride difluoride	alclf2
1038	ScF₃	Scandium trifluoride	ScF3
1039	AlFCl₂	Aluminum dichloride fluoride	alcl2f
1040	AlCl₃	Aluminum trichloride	alcl3
1041	GaCl₃	Gallium trichloride	gacl3
1042	BBr₃	Boron tribromide	bbr3
1043	AlBr₃	Aluminum Bromide	albr3
1044	ClO₃	Chlorine trioxide	clo3
1045	ClO₃^-	chlorate anion	clo3-
1046	BrO₃^-	Bromate anion	bro3-
1047	CF₃	Trifluoromethyl radical	cf3
1048	CF₃^-	Trifluoromethyl anion	cf3-
1049	CF₃⁺	Trifluoromethyl cation	cf3+
1050	SiF₃	Silicon trifluoride radical	sif3
1051	SiF₃⁺	Silicon trifluoride cation	sif3+
1052	CCl₃	Trichloromethyl radical	ccl3
1053	CCl₃^-	Trichloromethyl anion	ccl3-
1054	CCl₃⁺	Trichloromethyl cation	ccl3+
1055	SiCl₃	trichlorosilyl radical	sicl3
1056	SiCl₃⁺	trichlorosilyl cation	sicl3+
1057	CBr₃	tribromomethyl radical	cbr3
1058	FOOF	Perfluoroperoxide	foof
1059	ClO₂F	Chloryl fluoride	clo2f
1060	F₂SO	Thionyl Fluoride	f2so
1061	ClOOCl	Dichlorine dioxide	cloocl
1062	FSSF	Difluorodisulfane	fssf
1063	S₂F₂	Thio-thionyl fluoride	s2f2
1064	SOCl₂	thionyl chloride	socl2
1065	SeOCl₂	selenium oxychloride	seocl2
1066	NF₃^-	Nitrogen trifluoride anion	nf3-
1067	NF₃⁺	Nitrogen trifluoride cation	nf3+
1068	PF₃	Phosphorus trifluoride	pf3
1069	NCl₃	nitrogen trichloride	ncl3
1070	AsF₃	Arsenic trifluoride	asf3
1071	PCl₃	Phosphorus trichloride	pcl3
1072	SbF₃	Antimony Trifluoride	sbf3
1073	AsCl₃	Arsenous trichloride	ascl3
1074	SbCl₃	Antimony Trichloride	sbcl3
1075	NBr₃	Nitrogen Tribromide	nbr3
1076	PBr₃	Phosphorus tribromide	pbr3
1077	AsBr₃	Arsenic tribromide	asbr3
1078	NI₃	Nitrogen triiodide	ni3
1079	PI₃	Phosphorus triiodide	pi3
1080	ClSSCl	Disulfur dichloride	s2cl2
1081	SF₃	Sulfur trifluoride	sf3
1082	ClF₃	Chlorine trifluoride	clf3
1083	BrF₃	Bromine trifluoride	brf3
1084	IF₃	iodone trifluoride	if3
1085	HClO₃	Chloric Acid	hclo3
1086	CHF₂Cl	difluorochloromethane	chf2cl
1087	CHFCl₂	fluorodichloromethane	chfcl2
1088	CDCl₃	trichloromethane-d	cdcl3
1089	CHCl₃	Chloroform	chcl3
1090	SiHCl₃	Trichlorosilane	sihcl3
1091	CHFClBr	fluorochlorobromomethane	chfclbr
1092	CHBrCl₂	Methane, bromodichloro-	chbrcl2
1093	CHF₂I	difluoroiodomethane	chf2i
1094	CHFClI	fluorochloroiodomethane	chfcli
1095	CHCl₂I	dichloroiodomethane	chcl2i
1096	CHClBr₂	Methane, dibromochloro-	chclbr2
1097	CHBr₃	bromoform	chbr3
1098	CHI₃	Iodoform	chi3
1099	NF₃H⁺	protonated nitrogen trifluoride	nf3h+
1100	AsF₃H⁺	Arsenic trifluoride, protonated	asf3h+
1101	C₂H₂F₂	Ethene, 1,2-difluoro-, (E)-	c2h2f2e
1102	C₂H₂F₂	Ethene, 1,2-difluoro-, (Z)-	c2h2f2z
1103	CH₂CF₂	Ethene, 1,1-difluoro-	ch2cf2
1104	C₂H₂ClF	1-chloro-1-fluoroethylene	c2h2clf
1105	CHFCHCl	(E)-1-chloro-2-fluoroethene	chfchcle
1106	CHFCHClz	(Z)-1-Chloro-2-fluoroethene	chfchclz
1107	CH₂CCl₂	Ethene, 1,1-dichloro-	ch2ccl2
1108	CHClCHCl	Ethene, 1,2-dichloro-, (E)-	chclchcle
1109	CHClCHCl	Ethene, 1,2-dichloro-, (Z)-	chclchclz
1110	C₂H₂Br₂	1,1-dibromoethene	c2h2br2
1111	CHBrCHBr	Ethene, 1,2-dibromo-, (E)-	chbrchbre
1112	CHBrCHBr	Ethene, 1,2-dibromo-, (Z)-	chbrchbrz
1113	CH₂FCHO	Fluoroacetaldehyde	ch2fcho
1114	CH₃COF	Acetyl fluoride	ch3cof
1115	CH₂ClCHO	chloroacetaldehyde	ch2clcho
1116	CH₃COCl	Acetyl Chloride	ch3cocl
1117	CH₃CHF₂	Ethane, 1,1-difluoro-	ch3chf2
1118	CH₂FCH₂Cl	Ethane, 1-chloro-2-fluoro-	ch2fch2cl
1119	CH₃CHFCl	Ethane, 1-chloro-1-fluoro-	ch3chfcl
1120	CH₂ClCH₂Cl	Ethane, 1,2-dichloro-	ch2clch2cl
1121	CH₃CHCl₂	Ethane, 1,1-dichloro-	ch3chcl2
1122	CH₂BrCH₂Cl	1-bromo-2-chloroethane	ch2brch2cl
1123	CH₂BrCH₂Br	Ethane, 1,2-dibromo-	ch2brch2br
1124	CH₂CFCH₃	2-fluoropropene	2fpro
1125	CH₃CHCHF	trans-1-Fluoro-1-propene	propene1ft
1126	C₃H₅Cl	1-Propene, 3-chloro-	prop1cl3
1127	C₃H₅Cl	1-chloro-1-propene(E)	prop1cl1e
1128	C₃H₅Cl	1-chloro-1-propene(Z)	prop1cl1z
1129	CH₂FCH₂OH	2-fluoroethanol	ch2fch2oh
1130	CH₂ClCH₂OH	2-Chloroethanol	ch2clch2oh
1131	CH₂ClCH₂OH₂⁺	2-chloroethanol, protonated	ch2clch2oh2+
1132	CH₃CHFCH₃	2-Fluoropropane	prf2
1133	CH₂ClCH₂CH₃	Propane, 1-chloro-	prcl1
1134	CH₃CHClCH₃	Propane, 2-chloro-	prcl2
1135	CH₃CH₂CH₂Br	n-propyl bromide	prbr
1136	CH₃CHBrCH₃	i-propyl bromide	iprbr
1137	C₃H₉O⁺	trimethyl oxonium cation	c3h9o+
1138	B₅H₉	pentaborane9	b5h9
1139	C₅H₅	cyclopentadienyl radical	c5h5
1140	C₅H₅^-	cylopentadienyl anion	c5h5-
1141	C₅H₆	1,3-Cyclopentadiene	c542927
1142	C₅H₆	1-Buten-3-yne, 2-methyl-	c78808
1143	C₅H₆	3-Penten-1-yne, (E)-	c2004695
1144	C₅H₆	3-Penten-1-yne, (Z)-	c1574409
1145	C₅H₆	Bicyclo[2.1.0]pent-2-ene	c5164352
1146	C₅H₆	Cyclopropylacetylene	c6746947
1147	C₅H₆	Propellane	propellane
1148	C₅H₇	1,3-pentadienyl radical	pdyl
1149	C₅H₇	cyclopentenyl radical	cpyl
1150	C₅H₈	1,2-Butadiene, 3-methyl-	c598254
1151	C₅H₈	1,2-Pentadiene	c591957
1152	C₅H₈	1,3-Butadiene, 2-methyl-	c78795
1153	C₅H₈	1,3-Pentadiene, (E)-	c2004708
1154	C₅H₈	1,3-Pentadiene, (Z)-	c1574410
1155	C₅H₈	1,4-Pentadiene	c591935
1156	C₅H₈	1-pentyne	a1pentyne
1157	C₅H₈	2,3-Pentadiene	c591968
1158	C₅H₈	Bicyclo[1.1.1]pentane	bcp
1159	C₅H₈	Cyclobutane, methylene-	c1120565
1160	C₅H₈	Cyclopentene	c142290
1161	C₅H₈	Ethenylcyclopropane	c693867
1162	CH₃CCCH₂CH₃	2-Pentyne	2pentyne
1163	C₅H₁₀	1-Butene, 2-methyl-	c563462
1164	C₅H₁₀	2-Butene, 2-methyl-	c513359
1165	C₅H₁₀	2-Pentene, (E)-	c646048
1166	C₅H₁₀	2-Pentene, (Z)-	c627203
1167	C₅H₁₀	Cyclopentane	c287923
1168	C₅H₁₀	Cyclopropane, 1,1-dimethyl-	c1630940
1169	CH₂CHCH₂CH₂CH₃	1-pentene	pentene
1170	C₅H₁₁	2-Methylbut-2-yl radical	c4348350
1171	C₅H₁₂	Butane, 2-methyl-	buta2
1172	C₅H₁₂	Pentane	pentane
1173	C₅H₁₂	Propane, 2,2-dimethyl-	neopentane
1174	Si(CH₃)₄	tetramethylsilane	tms
1175	N₂O₃	Dinitrogen trioxide	n2o3
1176	C₃H₂N₂	Malononitrile	c3h2n2
1177	CH₂N₄	1H-Tetrazole	1htz
1178	C₃H₃N₂	imidazolyl radical	im
1179	C₃H₃N₂^-	imidizolyl anion	im-
1180	C₂H₃N₃	1H-1,2,4-Triazole	c288880
1181	C₄H₄N	pyrrolide radical	c4h4n
1182	C₄H₄N^-	pyrrolide anion	c4h4n-
1183	C₃H₄N₂	1H-Imidazole	1himidaz
1184	C₃H₄N₂	1H-Pyrazole	1hpyraz
1185	C₃H₄N₂	2H-Imidazole	imid2h
1186	C₃H₄N₂	4H-Imidazole	imid4h
1187	C₄H₅N	(E)-2-Butenenitrile	c627269
1188	C₄H₅N	(Z)-2-Butenenitrile	c1190767
1189	C₄H₅N	2H-pyrrole	pyrrole2
1190	C₄H₅N	3H-pyrrole	pyrrole3
1191	C₄H₅N	Cyclopropanecarbonitrile	c5500210
1192	C₄H₅N	Pyrrole	pyrrole
1193	CH₂CHCH₂CN	Allylcyanide	ch2chch2cn
1194	C₄H₆N⁺	pyrrole, alpha-protonated	appyr
1195	C₄H₆N⁺	pyrrole, beta-protonated	bppyr
1196	C₄H₆N⁺	pyrrole, protonated	ppyr
1197	C₃H₆N₂	3-Aminopropionitrile	c151188
1198	CH₃CH(CH₃)CN	Propanenitrile, 2-methyl-	c4h7n
1199	CH₃CH₂CH₂CN	Butanenitrile	c109740
1200	C₅H₈	Bicyclo[2.1.0]pentane	c185944
1201	C₅H₈	Spiropentane	c157404
1202	C₄H₉N	Cyclobutylamine	cbam
1203	C₄H₉N	Pyrrolidine	pyrrolidine
1204	C₃H₁₀N₂	1,2-Diaminopropane	diampr12
1205	C(CH₃)₃NH₂	2-Propanamine, 2-methyl-	c75649
1206	C(NH₂)H₂C(CH₃)HCH₃	1-Propanamine, 2-methyl-	c78819
1207	C(NH₂)H₂CH₂CH₂CH₃	1-Butanamine	butam1
1208	CH₃C(NH₂)HCH₂CH₃	2-Butanamine	butam2
1209	NH(C₂H₅)₂	diethylamine	dea
1210	NC₄H₁₂⁺	tetramethyl ammonium cation	nc4h12+
1211	C₃O₂⁺	Carbon suboxide cation	c3o2+
1212	MgCO₃	Magnesium Carbonate	mgco3
1213	BeCO₃	Beryllium Carbonate	beco3
1214	CaCO₃	Calcium Carbonate	caco3
1215	ONONO	Nitrosyl nitrite	onono
1216	PO₄^---	phosphate	po4---
1217	SO₄^--	sulfate	so4--
1218	HOONO₂	peroxy nitric acid	hoono2
1219	HSO₄^-	bisulfate anion	hso4-
1220	C₂H₂N₂S	1,3,4-Thiadiazole	c2h2n2s
1221	C₃H₂O₂	Propiolic acid	c3h2o2
1222	CHOCOOH	oxo acetic acid	oaa
1223	H₂SO₄	Sulfuric acid	h2so4
1224	H₂SeO₄	Selenic acid	h2seo4
1225	C₃H₃NO	Oxazole	oxazole
1226	C₃H₃NS	Thiazole	thiazole
1227	CH₃C(O)OO	acetyl peroxy radical	ch3coo2
1228	CH₃NO₃	Methyl nitrate	ch3no3
1229	H₃PO₄	Phosphoric Acid	h3po4
1230	C₄H₄O	Furan	furan
1231	C₄H₄O⁺	Furan cation	furan+
1232	CH₃COCCH	3-butyn-2-one	c1423605
1233	C₄H₄S	Thiophene	furans
1234	C₃H₄O₂	β–Propiolactone	beta
1235	C₃H₄O₂	2-Propenoic acid	propenoic2
1236	C₃H₄O₂	Methyl glyoxal	megly
1237	C₃H₄O₂	propanedial	propanedial
1238	C₃H₄O₂	propenalol	propenalol
1239	HOCHCCHOH	allenediol	aldiol
1240	C₂H₄O₃	1,2,3-trioxolane	c2h4o3
1241	C₂H₄O₃	trioxolane124	triox
1242	HOCH₂COOH	Hydroxyacetic acid	hac
1243	CH₂CHCONH₂	Acrylamide	c79061
1244	CH₃OCH₂CN	Methoxyacetonitrile	c1738369
1245	CH₅N₃S	Hydrazinecarbothioamide	c79196
1246	H₂NCH₂COOH	Glycine	glycine
1247	CH₃SO₂NH₂	methanesulfonamide	ch3so2nh2
1248	C₄H₆O	cis-2-butenal	butenal2c
1249	C₄H₆O	Cyclobutanone	cbutone
1250	C₄H₆O	Furan, 2,3-dihydro-	furan23h
1251	C₄H₆O	Furan, 2,5-dihydro-	furan25h
1252	CH₂CHOCHCH₂	Vinyl ether	vinylether
1253	CHOCHCHCH₃	2-Butenal	butenal2
1254	C₄H₆S	Thiophene, 2,3-dihydro-	thiop23h
1255	C₄H₆S	Thiophene, 2,5-dihydro-	thiop25h
1256	CH₂CHSCHCH₂	Divinyl sulfide	divis
1257	C₂H₆N₂O	Urea, methyl-	c598505
1258	C₃H₆O₂	1,3-Dioxolane	dioxolane
1259	CH₃CH₂COOH	Propanoic Acid	propanoic
1260	CH₃COOCH₃	methyl acetate	aame
1261	HCOOC₂H₅	Ethyl formate	faee
1262	C₂H₆O₂S	Dimethyl sulfone	c67710
1263	CH₃SSSCH₃	dimethyl trisulfide	c2h6s3
1264	C₃H₇NO	dimethylformamide	dmf
1265	C₃H₇NO	Propanamide	propanam
1266	C₂H₃OC₂H₅	Ethene, ethoxy-	c109922
1267	C₄H₈O	Cyclobutanol	c2919235
1268	C₄H₈O	Furan, tetrahydro-	thf
1269	CH₂C(CH₃)OCH₃	1-Propene, 2-methoxy-	pre1meo2
1270	CH₃COCH₂CH₃	2-Butanone	buta2one
1271	CHOCH(CH₃)CH₃	Propanal, 2-methyl-	c78842
1272	CHOCH₂CH₂CH₃	Butanal	butanal
1273	C₄H₈S	Thiophene, tetrahydro-	tht
1274	C₃H₈O₂	1,3-Propanediol	c504632
1275	C₃H₈O₂	Hydroperoxide, 1-methylethyl	c3031752
1276	C₃H₈O₂	Methane, dimethoxy-	c109875
1277	C₃H₈O₂	Propylene glycol	c57556
1278	C₃H₈S₂	1,3-Propanedithiol	c109808
1279	C₄H₁₀O	1-Butanol	butanol1
1280	C₄H₁₀O	1-Propanol, 2-methyl-	c78831
1281	C₄H₁₀O	2-Butanol, (.+/-.)-	butanol2
1282	C₄H₁₀O	Ethanol, 1,1-dimethyl-	tbuoh
1283	C₄H₁₀O	Ethoxy ethane	etoet
1284	C₄H₁₀O	Methyl propyl ether	meopr
1285	C₄H₁₀O	Propane, 2-methoxy-	c598538
1286	C₄H₁₀O⁺	1-Butanol cation	butanol1+
1287	C(CH₃)₃SH	2-Propanethiol, 2-methyl-	tbush
1288	C₂H₅SC₂H₅	Diethyl sulfide	etset
1289	C₄H₉SH	1-Butanethiol	bush
1290	CH₂(SH)CH(CH₃)CH₃	1-Propanethiol, 2-methyl-	c513440
1291	CH₃C(SCH₃)HCH₃	Propane, 2-(methylthio)-	mesipr
1292	CH₃CH(SH)CH₂CH₃	2-Butanethiol	butansl2
1293	FNO₃	Fluorine nitrate	fno3
1294	ClONO₂	Chlorine nitrate	clono2
1295	BrONO₂	Bromine nitrate	brono2
1296	TiCl₄	Titanium tetrachloride	ticl4
1297	ClO₄^-	perchlorate anion	clo4-
1298	BF₄^-	tetrafluoroboron anion	bf4-
1299	ClFO₃	Perchloryl fluoride	clfo3
1300	SO₂F₂	Sulfuryl fluoride	so2f2
1301	SO₂Cl₂	Sulfuryl chloride	so2cl2
1302	F₃NO	Nitrogen trifluoride oxide	f3no
1303	F₃PO	Phosphoryl fluoride	pf3o
1304	Cl₃PO	Phosphoryl chloride	pcl3o
1305	CF₄	Carbon tetrafluoride	cf4
1306	SiF₄	Silicon tetrafluoride	sif4
1307	TiF₄	Titanium tetrafluoride	tif4
1308	CFCl₃	Trichloromonofluoromethane	cfcl3
1309	CF₃Br	Bromotrifluoromethane	cf3br
1310	GeF₄	Germanium tetrafluoride	gef4
1311	CCl₄	Carbon tetrachloride	ccl4
1312	CCl₄⁺	Carbon tetrachloride cation	ccl4+
1313	CBrClF₂	Methane, bromochlorodifluoro-	cbrclf2
1314	SiCl₄	Silane, tetrachloro-	sicl4
1315	CBrCl₂F	bromodichlorofluoromethane	cbrcl2f
1316	CF₃I	trifluoroiodomethane	cf3i
1317	CBrCl₃	Methane, bromotrichloro-	cbrcl3
1318	CBr₂F₂	Methane, dibromodifluoro-	cbr2f2
1319	GeCl₄	Germanium Tetrachloride	gecl4
1320	CBr₂Cl₂	dibromodichloromethane	cbr2cl2
1321	CCl₃I	trichloroiodomethane	ccl3i
1322	CFBr₃	fluorotribromomethane	cfbr3
1323	CFClBrI	fluorochlorobromoiodomethane	cfclbri
1324	CBr₃Cl	tribromochloromethane	cbr3cl
1325	CF₂I₂	difluorodiiodomethane	cf2i2
1326	CBr₄	Carbon tetrabromide	cbr4
1327	CCl₂I₂	dichlorodiiodomethane	ccl2i2
1328	SiBr₄	Silicon tetrabromide	sibr4
1329	CBr₃I	tribromoiododmethane	cbr3i
1330	GeBr₄	Germanium tetrabromide	gebr4
1331	CI₄	tetraiodomethane	ci4
1332	SiI₄	silicon tetraiodide	sii4
1333	ClOF₃	Chlorine trifluoride oxide	clof3
1334	SF₄	Sulfur tetrafluoride	sf4
1335	SeF₄	Selenium tetrafluoride	sef4
1336	SCl₄	Sulfur tetrachloride	scl4
1337	C₂HF₃	Trifluoroethylene	c2hf3
1338	C₂HF₃⁺	Trifluoroethylene cation	c2hf3+
1339	CHClCCl₂	Trichloroethylene	chclccl2
1340	CHBrCF₂	1-Bromo-2,2-difluoroethylene	chbrcf2
1341	HClO₄	perchloric acid	hclo4
1342	HSO₃F	Fluorosulfonic acid	hso3f
1343	CF₃OH	trifluoromethanol	cf3oh
1344	CH₂ClCCCl	1,3-dichloropropyne	ch2clcccl
1345	CHClCCHCl	1,3-dichloroallene	chclcchcl
1346	CHCl₂CCH	3,3-dichloropropyne	chcl2cch
1347	CHCl₂CHO	dichloroacetaldehyde	chcl2cho
1348	PF₃CH₂	phosphorane, trifluoromethylene-	pf3ch2
1349	CH₃CF₃	Ethane, 1,1,1-trifluoro-	ch3cf3
1350	CH₃CF₂Cl	1-Chloro-1,1-Difluoroethane	ch3cf2cl
1351	CH₃CFCl₂	1,1-Dichloro-1-fluoroethane	ch3cfcl2
1352	CH₂ClCHCl₂	1,1,2-trichloroethane	ch2clchcl2
1353	CH₃CCl₃	Ethane, 1,1,1-trichloro-	ch3ccl3
1354	SiCl₃CH₃	methyltrichlorosilane	sicl3ch3
1355	CH₃CBr₃	1,1,1-tribromoethane	ch3cbr3
1356	NH₃BCl₃	Amminetrichloroboron	nh3bcl3
1357	SiH₃CCl₃	(trichloromethyl)silane	sih3ccl3
1358	CH₂CClCHCH₂	1,3-Butadiene, 2-chloro-	c4h5cl
1359	C₃H₅ClO	Oxirane, (chloromethyl)-	c106898
1360	CH₂FCH₂CH₂F	1,3-difluoropropane	ch2fch2ch2f
1361	CH₃CF₂CH₃	2,2-difluoropropane	ch3cf2ch3
1362	CH₂ClCH₂CH₂Cl	1,3-dichloropropane	prdicl13
1363	CH₂ClCHClCH₃	Propane, 1,2-dichloro-	prdicl12
1364	CH₃CCl₂CH₃	Propane, 2,2-dichloro-	prdicl22
1365	CHCl₂CH₂CH₃	1,1-dichloropropane	prdicl11
1366	SiCl₂(CH₃)₂	dichlorodimethylsilane	sicl2me2
1367	CH₂CClCH₂CH₃	1-Butene, 2-chloro-	bute1cl2
1368	CH₂CHCH₂CH₂Cl	1-Butene, 4-chloro-	bute1cl4
1369	CH₂CHCHClCH₃	1-Butene, 3-chloro-	bute1cl3
1370	CH₂ClCHCHCH₃	2-Butene, 1-chloro-	bute2cl1
1371	CH₃CClCHCH₃	2-Butene, 2-chloro-, (E)-	bute2cl2e
1372	CH₃CClCHCH₃	2-Butene, 2-chloro-, (Z)-	bute2cl2z
1373	CHClCHCH₂CH₃	(E)-1-Chloro-1-butene	bute1cl1
1374	CHClCHCH₂CH₃	(Z)-1-Chloro-1-butene	bute1cl1z
1375	C₄H₉F	1-fluorobutane	butaf1
1376	CH₃CHFCH₂CH₃	2-fluorobutane	butaf2
1377	CH₂ClCH₂CH₂CH₃	Butane, 1-chloro-	butacl1
1378	CH₃CCl(CH₃)CH₃	Propane, 2-chloro-2-methyl-	procl2me2
1379	CH₃CHClCH₂CH₃	Butane, 2-chloro-	butacl2
1380	XeF₄	Xenon tetrafluoride	xef4
1381	C₂H₂N₂O	Furazan	furazan
1382	CF₃PH₂	phosphine, (trifluoromethyl)-	cf3ph2
1383	NH₃BF₃	Amminetrifluoroboron	nh3bf3
1384	C₆H₂	hexatriyne	c6h2
1385	C₆H₄	(E)-Hexa-1,5-diyne-3-ene	c6h4e
1386	C₆H₄	(Z)-Hexa-1,5-diyne-3-ene	c6h4z
1387	C₆H₄	Benzyne	benzyne
1388	C₆H₅	phenyl	phenyl
1389	C₆H₅^-	phenyl anion	phenyl-
1390	C₆H₆	1,2,4,5-Hexatetraene	ht1245
1391	C₆H₆	2,4-Hexadiyne	hexadiyne
1392	C₆H₆	3,4-Dimethylenecyclobutene	cb34m
1393	C₆H₆	Benzene	benzene
1394	C₆H₆	Benzvalene	bv
1395	C₆H₆	Dewar Benzene	dewar
1396	C₆H₆	Hexa-1,5-diene-3-yne	hdy153
1397	C₆H₆	Trimethylenecycopropane	tmcp
1398	C₆H₆⁺	Benzene cation	c6h6+
1399	C₆H₇⁺	benzene, protonated	c6h7+
1400	C₆H₈	(E)-hexa-1,3,5-triene	c821078
1401	C₆H₈	(E)-hexa-2,3,4-triene	c59660650
1402	C₆H₈	(Z)-hexa-1,3,5-triene	hexatri135
1403	C₆H₈	(Z)-hexa-2,3,4-triene	hetr234c
1404	C₆H₈	1,3-Cyclohexadiene	cyhexadiene13
1405	C₆H₈	1,4-Cyclohexadiene	cyhexadiene14
1406	C₆H₈	3-Methylenecyclopentene	c930267
1407	C₆H₈	Bicyclo[2.1.1]hex-2-ene	c822413
1408	C₆H₈	Bicyclo[2.2.0]hex-1(4)-ene	c30830207
1409	C₆H₈	Bicyclo[3.1.0]hex-2-ene	c694019
1410	C₆H₁₀	1,3-Hexadiene, (E)-	hexdi13e
1411	C₆H₁₀	1,3-Hexadiene, (Z)-	hexdi13z
1412	C₆H₁₀	1,4-Hexadiene, (E)-	hexdi14t
1413	C₆H₁₀	1,4-Hexadiene, (Z)-	hexdi14z
1414	C₆H₁₀	1,5-Hexadiene	c592427
1415	C₆H₁₀	1-Butyne, 3,3-dimethyl-	c917920
1416	C₆H₁₀	1-Hexyne	hexyne1
1417	C₆H₁₀	2,4-Hexadiene, (E,E)-	hexdi24ee
1418	C₆H₁₀	2,4-Hexadiene, (E,Z)-	hexdi24ez
1419	C₆H₁₀	2,4-Hexadiene, (Z,Z)-	hexdi24zz
1420	C₆H₁₀	2-Hexyne	c764352
1421	C₆H₁₀	3-Hexyne	hexyne3
1422	C₆H₁₀	cyclohexene	cyclohexene
1423	C₆H₁₀	Cyclopentene, 1-methyl-	c693890
1424	C₆H₁₀	Cyclopentene, 3-methyl-	c1120623
1425	C₆H₁₀	Cyclopentene, 4-methyl-	c1759815
1426	C₄H₆(CH₃)₂	1,1-dimethylcyclobutane	dmcb11
1427	C₆H₁₂	(1R,2R)-1,2-dimethylcyclobutane	dmcb12t
1428	C₆H₁₂	(1r,3r)-1,3-dimethylcyclobutane	dmcb13t
1429	C₆H₁₂	(E)-2-Hexene	e2hexene
1430	C₆H₁₂	(E)-3-methylpent-2-ene	c616126
1431	C₆H₁₂	(E)-hex-3-ene	e3hexene
1432	C₆H₁₂	(Z)-3-methylpent-2-ene	c922623
1433	C₆H₁₂	(Z)-hex-2-ene	z2hexene
1434	C₆H₁₂	(Z)-hex-3-ene	z3hexene
1435	C₆H₁₂	2,3-dimethylbut-1-ene	c563780
1436	C₆H₁₂	2,3-dimethyl-but-2-ene	tmeet
1437	C₆H₁₂	3-methylenepentane	c760214
1438	C₆H₁₂	cis-1,2-dimethylcyclobutane	dmcb12c
1439	C₆H₁₂	cis-1,3-dimethylcyclobutane	dmcb13c
1440	C₆H₁₂	Cyclohexane	cyclohexane
1441	C₆H₁₂	Cyclopentane, methyl-	c96377
1442	C₆H₁₂	Ethylcyclobutane	c4806615
1443	C₆H₁₂	hex-1-ene	hexene1
1444	C₆H₁₄	Butane, 2,2-dimethyl-	buta22
1445	C₆H₁₄	Butane, 2,3-dimethyl-	buta23
1446	C₆H₁₄	Hexane	hexane
1447	C₆H₁₄	Pentane, 2-methyl-	penta2
1448	C₆H₁₄	Pentane, 3-methyl-	penta3
1449	C₄N₂	2-Butynedinitrile	c4n2
1450	C₄H₂N₂	Fumaronitrile	c4h2n2
1451	C₂H₂N₄	sym-tetrazine	ttz
1452	C₃H₃N₃	1,3,5-Triazine	triazine135
1453	CH₃N₅	5-Aminotetrazole	c4418615
1454	C₄H₄N₂	1,3-Diazine	diazine13
1455	C₄H₄N₂	Pyrazine	pyrazine
1456	C₄H₄N₂	Pyridazine	pyridazine
1457	C₄H₄N₂	Succinonitrile	c110612
1458	C₂H₄N₄	1H-Tetrazole, 1-methyl-	c16681779
1459	C₂H₄N₄	1H-Tetrazole, 5-methyl-	c4076362
1460	C₂H₄N₄	2H-Tetrazole, 2-methyl-	c16681780
1461	C₅H₅N	Bicyclo[1.1.0]butane-1-carbonitrile	bibucn
1462	C₅H₅N	E-2,4-pentadienenitrile	bdcn
1463	C₅H₅N	Pyridine	pyridine
1464	B₃N₃H₆	borazine	borazine
1465	C₆H₆	Fulvene	fulvene
1466	C₅H₆N⁺	Pyridinium	c5h6n
1467	C₄H₆N₂	1H-Imidazole, 2-methyl-	c693981
1468	C₅H₇N	(E)-2-Pentenenitrile	c26294984
1469	C₅H₇N	(E)-3-Pentenenitrile	c16529661
1470	C₅H₇N	(Z)-2-Pentenenitrile	c25899507
1471	C₅H₇N	1H-Pyrrole, 1-methyl-	c96548
1472	C₅H₇N	Cyclobutanecarbonitrile	c4426113
1473	C₅H₉N	1,2,3,6-Tetrahydropyridine	c694053
1474	C₅H₉N	Butanenitrile, 2-methyl-	c18936179
1475	C₅H₉N	Pentanenitrile	c110598
1476	C₅H₉N	Propanenitrile, 2,2-dimethyl-	c630182
1477	C₆H₁₀	Bicyclo[3.1.0]hexane	c285585
1478	C₅H₁₁N	Cyclopentanamine	cypentam
1479	C₅H₁₁N	Piperidine	piper
1480	C₄H₁₂N₂	1,2-Butanediamine	c4426486
1481	C₄H₁₂N₂	2-Methyl-1,2-propanediamine	c811938
1482	Li₂CO₃	Lithium Carbonate	li2co3
1483	Na₂CO₃	Sodium Carbonate	na2co3
1484	C₂O₄^--	oxalate anion	c2o4
1485	MgSO₄	Magnesium Sulfate	mgso4
1486	N₂O₄	Dinitrogen tetroxide	n2o4
1487	C₂H₂O₄	Oxalic Acid	oxalic
1488	C₂H₃NO₃	Oxamic acid	oxamic
1489	C₄H₄O₂	2(5H)-Furanone	furanone
1490	C₄H₄O₂	2-Oxetanone, 4-methylene-	c674828
1491	C₂H₄N₂O₂	Oxalamide	oxalamide
1492	C₂H₄N₂S₂	Ethanedithioamide	c79403
1493	C₂H₄CO₃	Ethylene carbonate	etco3
1494	C₃H₄O₂S	2H-Thiete-1,1-dioxide	c7285327
1495	C₃H₄S₃	1,3-Dithiolane-2-thione	c822388
1496	C₂H₄O₄	Formic acid dimer	fadimer
1497	C₄H₅NO	3-Methylisoxazole	isox3m
1498	C₄H₅NO	Isoxazole, 5-methyl-	c5765446
1499	C₄H₅NS	4-Methylthiazole	c693958
1500	C₂H₅NO₃	Nitric acid, ethyl ester	c625581
1501	C₅H₆O	2H-Pyran	pyran2
1502	C₅H₆O	2-methylfuran	furan2m
1503	C₅H₆O	3-Methylfuran	furan3m
1504	C₅H₆O	Pentadienal	pdal
1505	C₅H₆S	Thiophene, 2-methyl-	c554143
1506	C₅H₆S	Thiophene, 3-methyl-	c616444
1507	C₄H₆O₂	γ–Butyrolactone	c96480
1508	C₄H₆O₂	2,3-Butanedione	c431038
1509	C₄H₆O₂	2-Propenoic acid, methyl ester	c96333
1510	C₄H₆O₂	Crotonic Acid	crot
1511	C₄H₆OS	2,3-dihydrothiophene-2-ol	c9000117
1512	C₄H₆OS	2,5-dihydrothiophene-3-ol	c9000093
1513	C₄H₆OS	4,5-dihydrothiophene-2-ol	c9000106
1514	C₄H₆OS	4,5-dihydrothiophene-3-ol	c9000082
1515	C₄H₆OS	Dihydro-2-(3H)-thiophenone	c1003107
1516	C₄H₆OS	Dihydro-3-(2H)-thiophenone	c1003049
1517	C₄H₆OS	Vinyl sulfoxide	c1115157
1518	CH₆N₄S	Carbonothioic dihydrazide	thiacarb
1519	C₂H₆N₂O₂	(E)-Azodioxymethane	c37765154
1520	C₂H₆N₂O₂	Dimethylnitroamine	c4164287
1521	C₃H₆O₃	1,3,5-Trioxane	trioxane
1522	C₃H₆S₃	1,3,5-Trithiane	c3h6s3
1523	C₃H₆S₃	Carbonotrithioic acid, dimethyl ester	c2314489
1524	C₂H₆O₃S	Sulfurous acid, dimethyl ester	c616422
1525	C₄H₇NO	2-Pyrrolidinone	c616455
1526	C₄H₇NO	Ethoxyacetonitrile	etoaccn
1527	C₄H₇NO	Methacrylamide	c79390
1528	C₄H₇NO	Oxazole, 4,5-dihydro-2-methyl-	c1120645
1529	HCONH₂CN₂H₄	formamide aminomethanimine dimer	d13
1530	C₃H₇ONO	Propyl nitrite	prono
1531	CH₃CH(CH₃)ONO	Isopropyl nitrite	c541424
1532	CH₃CH(NH₂)COOH	Alanine	alanine
1533	CH₃NHCH₂COOH	Sarcosine	sarcosine
1534	NH₂CH₂CH₂COOH	β–alanine	betaalanine
1535	NH₂COOC₂H₅	Urethane	urethane
1536	C₅H₈O	2H-Pyran, 3,4-dihydro-	c110872
1537	C₅H₈O	Cyclopentanone	c120923
1538	C₅H₈O	Furan, 2,3-dihydro-5-methyl-	c1487156
1539	C₅H₈O	Methyl cyclopropyl ketone	c765435
1540	N(CH₃)₂CONH₂	Urea, N,N-dimethyl-	c598947
1541	NH(CH₃)CONH(CH₃)	Urea, N,N'-dimethyl-	c96311
1542	NH₂CONHC₂H₅	Urea, ethyl-	c625525
1543	C₄H₈O₂	1,3-Dioxane	dioxan13
1544	C₄H₈O₂	1,3-Dioxolane, 2-methyl-	c497267
1545	C₄H₈O₂	1,4-Dioxane	dioxan14
1546	C₄H₈O₂	Ethene, 1,1-dimethoxy-	c922690
1547	C₄H₈O₂	Ethyl acetate	c141786
1548	C₄H₈OS	s-Ethyl thioacetate	c625605
1549	C₃H₈O₃	1,2,3-Propanetriol	glycerin
1550	C₃H₈O₂S	(Methylsulfonyl)ethane	c594434
1551	C₄H₉NO	Butanamide	c541355
1552	C₄H₉NO	Propanamide, 2-methyl-	c563837
1553	C₅H₁₀O	2-Butanone, 3-methyl-	c563804
1554	C₅H₁₀O	2H-Pyran, tetrahydro-	c142687
1555	C₅H₁₀O	2-methylbutyraldehyde	2meba
1556	C₅H₁₀O	2-Pentanone	mpk
1557	C₅H₁₀O	3-Pentanone	dek
1558	C₅H₁₀O	Cyclopentanol	c96413
1559	C₅H₁₀O	Oxetane, 3,3-dimethyl-	c6921353
1560	C₅H₁₀O	Pentanal	pal
1561	C₅H₁₀S	2H-Thiopyran, tetrahydro-	c1613510
1562	C₅H₁₀S	3-Ethylthio-1-propene	c5296628
1563	C₅H₁₀S	Cyclopentanethiol	c1679078
1564	C₅H₁₀S	Thiophene, tetrahydro-2-methyl-	c1795091
1565	C₅H₁₀S	Thiophene, tetrahydro-3-methyl-	c4740005
1566	C₄H₁₀O₂	1,1-Dimethoxyethane	c534156
1567	C₄H₁₀O₂	1,3-Butanediol	budiol13
1568	C₄H₁₀O₂	1,4-Butanediol	budiol14
1569	C₄H₁₀O₂	Ethane, 1,2-dimethoxy-	c110714
1570	C₄H₁₀OS	Diethyl sulfoxide	c70291
1571	C₄H₁₀S₂	1,4-Butanedithiol	budisl14
1572	C₄H₁₁NO	Diethylhydroxylamine	c3710847
1573	C₅H₁₂O	1-Butanol, 2-methyl-	c137326
1574	C₅H₁₂O	1-Butanol, 3-methyl-	c123513
1575	C₅H₁₂O	1-Pentanol	pentanol1
1576	C₅H₁₂O	2-Butanol, 3-methyl-	c598754
1577	C₅H₁₂O	2-Pentanol	peol2
1578	C₅H₁₂O	3-Pentanol	pentan3ol
1579	C₅H₁₂O	Butane, 1-methoxy-	meobu
1580	C₅H₁₂O	Propane, 1-ethoxy-	proet
1581	C₅H₁₂O	Propane, 2-methoxy-2-methyl-	c1634044
1582	C₅H₁₂S	1-Butanethiol, 2-methyl-	c1878188
1583	C₅H₁₂S	1-Butanethiol, 3-methyl-	c541311
1584	C₅H₁₂S	1-Pentanethiol	c110667
1585	C₅H₁₂S	1-Propanethiol, 2,2-dimethyl-	c1679089
1586	C₅H₁₂S	2-Butanethiol, 2-methyl-	c1679090
1587	C₅H₁₂S	2-Butanethiol, 3-methyl-	c2084186
1588	C₅H₁₂S	Butane, 1-(methylthio)-	c628295
1589	C₅H₁₂S	Ethyl propyl sulfide	c4110503
1590	C₅H₁₂S	Propane, 2-(ethylthio)-	c5145993
1591	C₅H₁₂S	Propane, 2-methyl-2-(methylthio)-	c6163640
1592	C₄F₂	difluorobutadiyne	c4f2
1593	ClCOClCO	Oxalyl chloride	oxcl
1594	CF₃CN	Acetonitrile, trifluoro-	cf3cn
1595	CF₃CN⁺	Acetonitrile, trifluoro- cation	cf3cn+
1596	B₂F₄	Diboron tetrafluoride	b2f4
1597	B₂Cl₄	Diboron tetrachloride	b2cl4
1598	C₂F₄	Tetrafluoroethylene	c2f4
1599	C₂F₄⁺	Tetrafluoroethylene cation	c2f4+
1600	C₂ClF₃	Ethene, chlorotrifluoro-	c2f3cl
1601	CF₂CCl₂	difluorodichloroethylene	cf2ccl2
1602	CFClCClF	trans-1,2-dichloro-1,2-difluoroethylene	cfclcclf
1603	CFClCFCl	cis-1,2-dichloro-1,2-difluoroethylene	cfclcfcl
1604	C₂FCl₃	fluorotrichloroethene	c2fcl3
1605	C₂Cl₄	Tetrachloroethylene	c2cl4
1606	C₂Br₄	tetrabromoethene	c2br4
1607	CF₃OF	Trifluoromethylhypofluorite	cf3of
1608	SiF₅^-	silicon pentafluoride anion	sif5-
1609	SOF₄	Sulfur tetrafluoride oxide	sof4
1610	PF₅	Phosphorus pentafluoride	pf5
1611	AsF₅	Arsenic pentafluoride	asf5
1612	PCl₅	Phosphorus pentachloride	pcl5
1613	SF₅	Sulfur pentafluoride	sf5
1614	SF₅⁺	pentafluoro sulfur cation	sf5+
1615	SbCl₅	Antimony pentachloride	sbcl5
1616	BrF₅	bromine pentafluoride	brf5
1617	ClF₅	chlorinepentafluoride	clf5
1618	IF₅	pentafluoroiodine	if5
1619	CF₃CHO	trifluoroacetaldehyde	cf3cho
1620	CCl₃CHO	trichloroacetaldehyde	ccl3cho
1621	CHFClCHClF	ethane, 1,2-dichloro-1,2-difluoro-	chfclchclf
1622	CF₃CH₂F	1,1,1,2-tetrafluoroethane	cf3ch2f
1623	CHF₂CHF₂	1,1,2,2-tetrafluoroethane	chf2chf2
1624	CF₃CH₂Cl	2,2,2-Trifluoroethyl chloride	cf3ch2cl
1625	CHFClCHFCl	1,2-dichloro-1,2-difluoroethane RR	chfclchfcl
1626	CH₂ClCCl₃	1,1,1,2-tetrachloroethane	ch2clccl3
1627	CHCl₂CHCl₂	Ethane, 1,1,2,2-tetrachloro-	chcl2chcl2
1628	CH₂BrCBr₃	1,1,1,2-tetrabromo ethane	c2h2br4
1629	CHCl₂CHF₂	1,1-dichloro-2,2-difluoroethane	c2h2cl2f2
1630	CF₃COOH	trifluoroacetic acid	cf3cooh
1631	C₄H₃ClO	Furan, 2-chloro	fur2cl
1632	C₄H₃ClO	Furan,3-chloro	fur3cl
1633	C₃H₅ClO₂	Carbonochloridic acid, ethyl ester	c541413
1634	C₃H₅Cl₃	Propane, 1,2,3-trichloro-	prcl135
1635	C₄H₈Cl₂	1,4-Dichlorobutane	c110565
1636	C₄H₈Cl₂	Butane, 1,2-dichloro-	c616217
1637	C₄H₈Cl₂	Butane, 1,3-dichloro-	c1190223
1638	C₄H₈Cl₂	Butane, 2,3-dichloro-, (r,r)-(.+/-.)-	c2211678
1639	C₄H₈Cl₂	Butane, 2,3-dichloro-, (r,s)-	c4028562
1640	C₄H₉ClO	1-Chloro-2-ethoxyethane	c628342
1641	C₅H₁₁Cl	Pentane, 1-chloro-	pencl1
1642	C₄H₈O₂	Butanoic acid	bua
1643	C₆H₅CH₂	benzyl radical	benzyl
1644	C₇H₇	cycloheptatrienyl radical	c7h7
1645	C₇H₇⁺	cycloheptatrienyl cation	c7h7+
1646	C₆H₅CH₃	toluene	toluene
1647	C₇H₈	cycloheptatriene	cht
1648	C₇H₈	Norbornadiene	norbor
1649	C₇H₈	Quadricyclane	qucy
1650	C₇H₁₂	Norbornane	nor
1651	C₇H₁₄	cycloheptane	c7h14
1652	C₇H₁₆	2-methylhexane	2mhex
1653	C₇H₁₆	3-methylhexane	hex3m
1654	C₇H₁₆	heptane	heptane
1655	CH(CN)₃	tricyanomethane	mecn3
1656	HN=C=C(CN)₂	Dicyanoketenimine	c4hn3
1657	C₆H₇N	2-Methylpyridine	mp
1658	C₆H₅NH₂	aniline	aniline
1659	C₆H₁₃N	2-Methylpiperidine	pip2m
1660	C₆H₁₃N	cyclohexanamine	cham
1661	C₆H₁₅N	triethylamine	tea
1662	N₂O₅	Dinitrogen pentoxide	n2o5
1663	C₄H₂O₃	Maleic Anhydride	malan
1664	C₅H₄O₂	4-Cyclopentene-1,3-dione	cpdio
1665	C₅H₄O₂	furfural	furfural
1666	C₆H₅O	phenoxy radical	phenoxy
1667	C₅H₅NO	2(1H)-Pyridinone	c72762006
1668	C₅H₅NO	2(3H)-Pyridinone	c9000048
1669	C₅H₅NO	2(5H)-Pyridinone	c9000037
1670	C₅H₅NO	2-Pyridinol	c109104
1671	C₅H₅NO	3(2H)-Pyridinone	c9000004
1672	C₅H₅NO	3(4H)-Pyridinone	c9000026
1673	C₅H₅NO	3(6H)-Pyridinone	c9000015
1674	C₅H₅NO	3-Pyridinol	c109002
1675	C₅H₅NO	4(1H)-Pryidinone	c9000060
1676	C₅H₅NO	4(3H)-Pryidinone	c9000059
1677	C₅H₅NO	4-Pyridinol	c626642
1678	C₆H₅OH	phenol	phenol
1679	C₆H₆O	2,4-Cyclohexadienone	c24599573
1680	C₆H₆O	2,5-Cyclohexadienone	c5664335
1681	C₆H₅SH	Benzenethiol	phsh
1682	HO₂CCHNH₂CH₂OH	Serine	serine
1683	C₅H₈O₂	Acetylacetone	acac
1684	C₄H₈O₂S	Sulfolane	sulfolane
1685	C₇H₁₀	Norbornene	norbornene
1686	CH(C₂H₃)₃	trivinyl methane	tvm
1687	C₆H₁₀O	cyclohexanone	chexo
1688	C₆H₁₂O	hexanal	c6h12o
1689	C₆H₁₂O	Oxepane	oxepane
1690	C₃H₇OC₃H₇	di-n-propyl ether	propr
1691	F₂CCCF₂	tetrafluoroallene	pfa
1692	CF₃COO^-	trifluoro acetate anion	cf3coo-
1693	CF₃COF	trifluoroacetyl fluoride	cf3cof
1694	CF₃COCl	trifluoroacetyl chloride	cf3cocl
1695	PF₆	Hexafluorophosphate neutral	pf6
1696	PF₆^-	Hexafluorophosphate ion	pf6-
1697	SeF₆	Selenium hexafluoride	sef6
1698	SF₅Cl	sulfur chloropentafluoride	sf5cl
1699	CF₃CHF₂	pentafluoroethane	cf3chf2
1700	CF₃CHFCl	1,1,1,2-tetrafluorochloroethane	cf3chfcl
1701	CF₃CHCl₂	1,1-Dichloro-2,2,2-trifluoroethane	cf3chcl2
1702	CHCl₂CClF₂	Ethane, 1,2,2-trichloro-1,1-difluoro-	chcl2cclf2
1703	CCl₃CHCl₂	pentachloroethane	ccl3chcl2
1704	C₆H₅F	Fluorobenzene	bzf
1705	C₆H₅Cl	chlorobenzene	bzcl
1706	C₆H₅Br	bromobenzene	bzbr
1707	C₈H₆	Calicene	calicene
1708	C₆H₅CCH	phenylacetylene	phac
1709	C₈H₆	benzocyclobutadiene	bcbd
1710	C₈H₆	Pentalene	pentalene
1711	C₆H₅CHCH₂	Styrene	styrene
1712	C₈H₈	cubane	cubane
1713	C₈H₈	cyclooctatetraene	cot
1714	C₆H₅CH₂CH₃	Ethylbenzene	etbz
1715	CH₃C₆H₄CH₃	meta-xylene	mxylene
1716	CH₃C₆H₄CH₃	paraxylene	pxylene
1717	C₈H₁₄	Bicyclo[2.2.2]octane	bico222
1718	C₈H₁₆	cyclooctane	cyclooct
1719	(CH₃)₃CC(CH₃)₃	tetramethylbutane	tmb
1720	C₈H₁₈	Octane	c8h18
1721	C₆H₅CN	phenyl cyanide	phcn
1722	C₆H₁₂N₂	Triethylenediamine	ted
1723	C₄O₄^--	squarate dianion	c4o4--
1724	S₄N₄	Tetrasulfur tetranitride	s4n4
1725	S₈	Octasulfur	s8
1726	C₆H₄O₂	parabenzoquinone	pbq
1727	C₄H₄N₂O₂	Uracil	uracil
1728	C₆H₅OCH₃	Anisole	anisole
1729	C₅H₉NO₂	Proline	proline
1730	C₆H₁₂O₂	Methyl pivalate	c598981
1731	C₆H₁₂O₂	Hexanoic acid	hexa
1732	C₄F₄	tetrafluorcyclobutadiene	c4f4
1733	Al₂Cl₆	Aluminum, di-μ-chlorotetrachlorodi-	al2cl6
1734	CF₃CF₂Cl	pentafluorochloroethane	cf3cf2cl
1735	CF₂ClCF₂Cl	1,2-Dichloro-1,1,2,2-tetrafluoroethane	cf2clcf2cl
1736	CF₃CFCl₂	1,1-Dichlorotetrafluoroethane	cf3cfcl2
1737	CF₂ClCFCl₂	Ethane, 1,1,2-trichloro-1,2,2-trifluoro-	cf2clcfcl2
1738	CF₃CCl₃	1,1,1-trifluoro-2,2,2-trichloroethane	cf3ccl3
1739	C₂F₆	hexafluoroethane	c2f6
1740	C₂Cl₆	hexachloroethane	c2cl6
1741	IF₇	Iodine heptafluoride	if7
1742	C₆H₄F₂	metadifluorobenzene	mdfb
1743	C₆H₄F₂	orthodifluorobenzene	odfb
1744	C₆H₄F₂	1,4-difluorobenzene	pdfb
1745	C₆H₄Cl₂	1,2-dichlorobenzene	dcb12
1746	C₆H₄Cl₂	1,3-dichlorobenzene	dcb13
1747	C₆H₄Cl₂	1,4-dichlorobenzene	dcb14
1748	C₆H₅NO	nitrosobenzene	bzno
1749	C₉H₈	Indene	indene
1750	C₉H₈	spiro[4.4]nona-1,3,6,8-tetraene	snt
1751	C₉H₁₂	n-propyl benzene	prbz
1752	C₉H₂₀	Nonane	nonane
1753	C(CN)₄	tetracyanomethane	c5n4
1754	C₅H₄N₄	purine	purine
1755	C₈H₇N	Indole	indole
1756	C₃H₃N₃O₃	cyanuric acid	cyanuric
1757	C₆H₅NO₂	Nitrobenzene	c6h5no2
1758	C₆H₅COOH	benzoic acid	benzo
1759	CH₃COC₆H₅	acetophenone	acph
1760	C₃Cl₃N₃	1,3,5-Triazine, 2,4,6-trichloro-	c3cl3n3
1761	C₃F₆	hexafluoropropene	c3f6
1762	C₆H₃F₃	Benzene trifluoride 123	bzf3a
1763	C₈H₁₈O	1-Octanol	octanol
1764	C₁₀H₈	Azulene	azu
1765	C₁₀H₈	naphthalene	naph
1766	C₁₀H₁₀	bullvalene	bullv
1767	C₁₀H₁₆	adamantane	adamantane
1768	C₆N₄	Tetracyanoethylene	tcne
1769	C₆N₄^-	tetracyanoethylene anion	tcne-
1770	C₁₀H₂₂	Decane	decane
1771	C₄F₆	perfluorobutadiene	c4f6
1772	SF₅CF₃	Sulfur, pentafluoro(trifluoromethyl)-	sf5cf3
1773	C₃F₈	perfluoropropane	c3f8
1774	Fe(CO)₅	Iron pentacarbonyl	ipc
1775	Fe(C₅H₅)₂	ferrocene	fecp2
1776	B₁₂H₁₂^--	Dodecahydrododecaborate(2-)	b12h12--
1777	B₁₂H₁₂^--	Dodecahydrododecaborate(2-)	b12h12--
1778	C₁₂H₈	Acenaphthylene	acenaph
1779	C₁₂H₈	biphenylene	biph
1780	C₁₂H₁₀	biphenyl	biphenyl
1781	C₁₂H₁₀	Heptalene	heptalene
1782	C₆H₁₂O₆	Inositol	inositol
1783	C₆F₆	hexafluorobenzene	c6f6
1784	S₂F₁₀	disulphur decafluoride	s2f10
1785	C₁₃H₁₀	Fluorene	fluorene
1786	C₁₄H₁₀	Anthracene	anth
1787	C₁₄H₁₀	Phenanthrene	phenanthrene
1788	C₁₄H₁₄	Bibenzyl	bibenzyl
1789	C₁₂H₁₀N₂	azobenzene	azobenzene
1790	C₆H₅COC₆H₅	benzophenone	benzophenone
1791	C₁₆H₁₀	Pyrene	pyrene
1792	C₁₈H₁₂	Tetracene	tetracene
1793	C₁₉H₁₆	Triphenylmethane	tpm
1794	C₂₄H₁₂	Coronene	coronene
1795	C₆₀	Buckminsterfullerene	c60

Computational Chemistry Comparison and Benchmark DataBase
Release 22	May 2022
NIST Standard Reference Database 101

I	Introduction
II	Experimental data
III	Calculated data
IV	Data comparisons
V	Cost comparisons
VI	Input and output files
VII	Tutorials and Units
VIII	Links to other sites
IX	Feedback
X	Older CCCBDB versions
XII	Geometries
XIII	Vibrations
XIV	Reaction data
XV	Entropy data
XVI	Bibliographic data
XVII	Ion data
XVIII	Bad calculations
XIX	Index of properties
XX	H-bond dimers
XXI	Oddities