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

List of which calculations are completed at QCISD(TQ) /cc-pVDZ

count	Species	Name	State	Conformation
1	H	Hydrogen atom	¹S	K_h
2	He	Helium atom	¹S	K_h
3	He	Helium atom
4	Li	Lithium atom	²S	K_h
5	MgH	magnesium monohydride	²Σ	C_∞v
6	MgH₂	magnesium dihydride	¹Σ_g	D_∞h
7	B	Boron atom	²P	K_h
8	Al^-	Aluminum atom anion	³P	K_h
9	BH	Boron monohydride	¹Σ	C_∞v
10	ScH	Scandium monohydride	¹Σ	C_∞v
11	BH₃⁺	boron trihydride cation	²B₂	C_2v
12	BH₃⁺	boron trihydride cation		C_2v
13	AlH₃	aluminum trihydride	¹A₁^'	D_3h
14	AlH₃^-	aluminum trihydride anion		C_3v
15	ScH₃	Scandium trihydride	¹A₁^'	D_3h
16	ScH₃	Scandium trihydride	¹A₁	C_3v
17	BH₄	borohydride	²B₂	C_2v
18	BH₄^-	borohydride anion	¹A₁	T_d
19	C	Carbon atom	³P₀	K_h
20	C	Carbon atom	³P₁	K_h
21	C^-	Carbon atom anion	²D	K_h
22	Si	Silicon atom	³P	K_h
23	Si	Silicon atom	¹S	K_h
24	Si^-	Silicon atom anion	⁴S	K_h
25	SiH	Silylidyne	²Π	C_∞v
26	SiH⁺	silicon monohydride cation	¹Σ	C_∞v
27	GeH	germylidene	²Π	C_∞v
28	GeH⁺	Germaniun monohyrdide cation	¹Σ	C_∞v
29	CH₂	Methylene	³B₁	C_2v
30	CH₂	Methylene	³Σ_G	D_∞h
31	CH₂	Methylene	¹A₁	C_2v
32	CH₂^-	methylene anion	²B₁	C_2v
33	CH₂⁺	methylene cation	²A₁	C_2v
34	CH₂⁺	methylene cation	²Π	D_∞h
35	GeH₂	germylene	¹A₁	C_2v
36	CH₃	Methyl radical	²A₁	D_3h
37	CH₃^-	methyl anion	¹A₁	C_3v
38	CH₃⁺	methyl cation	¹A₁^'	D_3h
39	SiH₃	Silyl radical	²A₁	C_3v
40	SiH₃⁺	Silyl cation	¹A₁^'	D_3h
41	CH₄	Methane	¹A₁	T_d
42	CH₄^-	Methane anion	²A₁	T_d
43	CH₄^-	Methane anion	²A₁	C_3v
44	SiH₂D₂	silane-d2
45	SiH₄	Silane	¹A₁	T_d
46	GeH₄	Germane	¹A₁	T_d
47	SiH₅⁺	Silane, protonated
48	N	Nitrogen atom	⁴S	K_h
49	N	Nitrogen atom	²D	K_h
50	N⁺	Nitrogen atom cation	³P	K_h
51	P	Phosphorus atom	⁴S	K_h
52	V	Vanadium atom	⁴F	K_h
53	V⁺	Vanadium atom cation	⁵D	K_h
54	As	Arsenic atomic	⁴S	K_h
55	As^-	Arsenic anion	³P	K_h
56	As⁺	Arsenic cation	³P	K_h
57	PH	phosphorus monohydride	³Σ^-	C_∞v
58	NH₂	Amino radical	²B₁	C_2v
59	NH₂⁺	Amino cation	³B₁	C_2v
60	NH₂⁺	Amino cation	¹A₁	C_2v
61	NH₃	Ammonia	¹A₁	C_3v
62	NH₃^-	Ammonia anion	²A₁	C_3v
63	NH₃⁺	ammonia cation	²A₂^"	D_3h
64	PH₃	Phosphine	¹A₁	C_3v
65	PH₃⁺	Phosphine cation	²A₁	C_3v
66	NH₄⁺	ammonium cation	¹A₁	T_d
67	PH₄	Phosphoranyl radical
68	PH₄⁺	phosphonium cation
69	O	Oxygen atom	³S	K_h
70	O⁺	Oxygen atom cation	⁴S	K_h
71	S	Sulfur atom	³P	K_h
72	S^-	Sulfur atom anion	²P	K_h
73	S⁺	Sulfur atom cation	⁴S	K_h
74	OH	Hydroxyl radical	²Π	C_∞v
75	OH^-	hydroxide anion	¹Σ	C_∞v
76	OH⁺	hydoxyl cation	³Σ	C_∞v
77	HS	Mercapto radical	²Π	C_∞v
78	HS^-	mercapto anion	¹Σ	C_∞v
79	HS⁺	sulfur monohydride cation	³Σ	C_∞v
80	CrH⁺	Chromium hydride cation	⁵Σ	C_∞v
81	HSe⁺	selenium monohydride cation	³Σ	C_∞v
82	H₂O	Water	¹A₁	C_2v
83	H₂O^-	water anion	²A₁	C_2v
84	H₂O^-	water anion	²A^'	C_s
85	H₂O⁺	water cation	²B₁	C_2v
86	HDO	Water-d1	¹A₁	C_2v
87	H₂S	Hydrogen sulfide	¹A₁	C_2v
88	H₂S⁺	Hydrogen sulfide cation	²B₁	C_2v
89	H₂Se	Hydrogen selenide	¹A₁	C_2v
90	H₃O⁺	hydronium cation	¹A₁	C_3v
91	H₃S⁺	Sulfonium cation	¹A₁	C_3v
92	H₃Se⁺	Hydrogen Selenide, protonated	¹A₁	C_3v
93	F	Fluorine atom	²P	K_h
94	F^-	Fluorine atom anion	¹S	K_h
95	F⁺	Fluorine atom cation	³S	K_h
96	F⁺	Fluorine atom cation	¹D	K_h
97	Cl	Chlorine atom	²P	K_h
98	Cl^-	Chlorine atom anion	¹S	K_h
99	Cl⁺	Chlorine atom cation	³P	K_h
100	Cl⁺	Chlorine atom cation	¹D	K_h
101	HF	Hydrogen fluoride	¹Σ	C_∞v
102	HCl	Hydrogen chloride	¹Σ	C_∞v
103	HCl⁺	hydrogen chloride cation	²Π	C_∞v
104	HBr	hydrogen bromide	¹Σ	C_∞v
105	H₂Cl⁺	dihydrogen monochloride cation	¹A₁	C_2v
106	H₂Br⁺	protonated hydrogen bromide	²A₁	C_2v
107	Ne	Neon atom	¹S	K_h
108	Ne	Neon atom
109	Ne⁺	Neon atom cation	²P	K_h
110	Ar	Argon atom	¹S	K_h
111	Kr	Krypton atom	¹S	K_h
112	Kr⁺	Krypton cation	²P	K_h
113	ArH⁺	Argon hydride cation	¹Σ	C_∞v
114	KrH⁺	Protonated Krypton	¹Σ	C_∞v
115	Na₂⁺	sodium diatomic cation	²Σ_g	D_∞h
116	BeMg	Beryllium Magnesium	¹Σ	C_∞v
117	NaAl	Sodium aluminum	¹Σ	C_∞v
118	BeB	Beryllium monoboride	²Π	C_∞v
119	B₂	Boron diatomic	¹Σ_g	D_∞h
120	B₂⁺	Boron diatomic cation	²Π	D_∞h
121	BAl	Boron Aluminum	³Σ	C_∞v
122	BGa	Boron Gallium	³Σ	C_∞v
123	AlGa	Aluminum Gallium	³Σ	C_∞v
124	AlGa	Aluminum Gallium	¹Σ	C_∞v
125	Ga₂	Gallium diatomic	³P_iu
126	HBBH	Diborane(2)	³Σ_G	D_∞h
127	B₂H₄	Diborane(4) D2d	¹A₁	D_2d
128	HBHHBH	Diborane(4) C2V	¹A₁	C_2v
129	B₂H₆	Diborane	¹A_g	D_2h
130	B₂H₆⁺	Diborane cation
131	Ga₂H₆	digallane	¹A_G	D_2h
132	BeC	Beryllium Carbide	³Σ^-	C_∞v
133	BeC	Beryllium Carbide
134	CaC	Calcium monocarbide
135	AlC	Aluminum carbide	⁴Σ	C_∞v
136	BSi	Boron silicide	⁴Σ	C_∞v
137	BSi	Boron silicide	²Σ	C_∞v
138	C₂	Carbon diatomic	¹Σ_g⁺	D_∞h
139	C₂	Carbon diatomic	³Σ_g^-
140	C₂⁺	carbon diatomic cation	⁴Σ_g	D_∞h
141	SiGe	Silicon Germanium
142	C₂H	Ethynyl radical	²Σ	C_∞v
143	C₂H₂	Acetylene	¹Σ_g	D_∞h
144	C₂H₂⁺	acetylene cation	²Π_u	D_∞h
145	H₂CC^-	vinylidene anion
146	CH₃Li	methyl lithium	¹A₁	C_3v
147	CH₂BH	methyleneborane	¹A₁	C_2v
148	C₂H₃	vinyl	²A^'	C_s
149	C₂H₃^-	vinyl anion	¹A^'	C_s
150	C₂H₄	Ethylene	¹A_g	D_2h
151	C₂H₄^-	Ethylene anion	²A_g	C_2h
152	C₂H₄⁺	Ethylene cation	²B₃	D₂
153	CH₃BH₂	methylborane	¹A^'	C_s
154	C₂H₅	Ethyl radical	²A^'	C_s
155	C₂H₆	Ethane	¹A_1g	D_3d
156	LiP	Lithium monophosphide
157	LiP	Lithium monophosphide
158	BeN⁺	Beryllium mononitride cation	³Σ	C_∞v
159	BeN⁺	Beryllium mononitride cation	¹Σ	C_∞v
160	MgN	Magnesium Nitride
161	BP	Boron monophosphide	³Π	C_∞v
162	BP	Boron monophosphide	¹Σ	C_∞v
163	AlP	Aluminum monophosphide	³Σ	C_∞v
164	AlP	Aluminum monophosphide	³Π	C_∞v
165	AlP	Aluminum monophosphide	¹Σ	C_∞v
166	GaN	Gallium mononitride	¹Σ	C_∞v
167	GaP	Gallium monophosphide	³Σ	C_∞v
168	GaP	Gallium monophosphide	¹Σ	C_∞v
169	GaAs	Gallium arsenide	³Π
170	GaAs	Gallium arsenide	¹Σ
171	BN	boron nitride	³Π	C_∞v
172	BN	boron nitride	¹Σ	C_∞v
173	CN	Cyano radical	²Σ	C_∞v
174	CN^-	cyanide anion	¹Σ	C_∞v
175	SiP	Silicon monophosphide	²Π	C_∞v
176	N₂	Nitrogen diatomic	¹Σ_g	D_∞h
177	N₂^-	nitrogen diatomic anion	²Π_g	D_∞h
178	HCN	Hydrogen cyanide	¹Σ	C_∞v
179	HCN⁺	hydrogen cyanide cation	²Π	C_∞v
180	HNC⁺	hydrogen isocyanide cation
181	NNH⁺	Dinitrogen monohydride cation	¹Σ	C_∞v
182	N₂H₂	(E)-diazene	¹A_g	C_2h
183	N₂H₂	(Z)-Diazene	¹A₁	C_2v
184	N₂H₂⁺	trans-diazene cation	²A_G	C_2h
185	CH₂NH⁺	Methanimine cation
186	CH₂NH₂⁺	methyleneamine cation	¹A₁	C_2v
187	N₂H₄⁺	hydrazine cation	²A_G	C_2h
188	CH₃NH₂	methyl amine	¹A^'	C_s
189	CH₃NH₂⁺	methyl amine cation	²A^'	C_s
190	BH₃PH₃	borane phosphine
191	NH₃NH₃	Ammonia Dimer	¹A_g	C_2h
192	N₂H₇⁺	ammonia ammonium dimer
193	LiO	lithium oxide	²Σ	C_∞v
194	LiS	Lithium monosulfide	²Π	C_∞v
195	LiS⁺	Lithium sulfide cation	³Σ	C_∞v
196	NaO	sodium monoxide	²Σ	C_∞v
197	NaS	Sodium sulfide	²Π	C_∞v
198	CaS	Calcium sulfide	¹Σ	C_∞v
199	BO	boron monoxide	²Σ	C_∞v
200	ScO	Scandium monoxide	²Σ	C_∞v
201	CO	Carbon monoxide	¹Σ	C_∞v
202	CO^-	carbon monoxide anion	²Π	C_∞v
203	CO⁺	carbon monoxide cation	²Σ	C_∞v
204	TiO	Titanium monoxide	³Δ	C_∞v
205	GeO⁺	Germanium monoxide cation	²Σ	C_∞v
206	GeS	Germanium monosulfide	¹Σ	C_∞v
207	SiSe	Silicon Monoselenide
208	SiSe⁺	Silicon Monoselenide cation
209	NO	Nitric oxide	²Π	C_∞v
210	NO^-	nitric oxide anion	³Σ	C_∞v
211	NO⁺	nitric oxide cation	¹Σ	C_∞v
212	NS	Mononitrogen monosulfide	²Π	C_∞v
213	PO	Phosphorus monoxide	²Π	C_∞v
214	PS	phosphorus sulfide	²Σ	C_∞v
215	VO	Vanadium monoxide	⁴Σ^-
216	NSe	Nitrogen monoselenide	²Π	C_∞v
217	AsS	Arsenic monosulfide	²Π	C_∞v
218	PSe	Phosphorus monoselenide	²Π	C_∞v
219	AsSe	Arsenic monoselenide	²Π	C_∞v
220	O₂	Oxygen diatomic	³Σ_g	D_∞h
221	O₂^-	oxygen diatomic anion	²Π	D_∞h
222	SO⁺	sulfur monoxide cation	²Π	C_∞v
223	S₂	Sulfur diatomic	³Σ_g	D_∞h
224	LiOH	lithium hydroxide	¹Σ	C_∞v
225	BeOH	beryllium monohydroxide	²A^'	C_s
226	BeOH	beryllium monohydroxide	²Σ	C_∞v
227	HBO	Boron hydride oxide	¹Σ	C_∞v
228	COH	Hydroxymethylidyne
229	COH⁺	Carbon Monoxide, protonated	¹Σ	C_∞v
230	HCO^-	formyl anion	¹A^'	C_s
231	HNO⁺	Nitrosyl hydride cation	²A^'	C_s
232	NOH	Hydroxyimidogen	³A^"	C_s
233	NOH⁺	O-protonated nitric oxide	²A^'	C_s
234	HO₂	Hydroperoxy radical	²A^"	C_s
235	HO₂⁺	Hydroperoxy cation	³A^"	C_s
236	HSO⁺	Sulfur Monoxide, S-protonated
237	SOH⁺	Sulfur Monoxide, protonated
238	H₂CO	Formaldehyde	¹A₁	C_2v
239	H₂CO^-	formaldehyde anion	²A^'	C_s
240	H₂CO⁺	formaldehyde cation	²B₂	C_2v
241	H₂CS	Thioformaldehyde	¹A₁	C_2v
242	H₂NO	nitroxide	²B₁	C_2v
243	H₂NO	nitroxide	²A^'	C_s
244	H₂O₂	Hydrogen peroxide	¹A	C₂
245	H₂O₂	Hydrogen peroxide	¹A_g	C_2h
246	H₂S₂	Disulfane	¹A	C₂
247	H₂S₂⁺	hydrogen disulfide cation	²B_g	C_2h
248	CH₂OH	Hydroxymethyl radical	²A	C₁
249	CH₃O⁺	Methoxy cation	³A₁	C_3v
250	NH₂OH	hydroxylamine	¹A^'	C_s
251	NH₂OH⁺	Hydroxylamine cation
252	CH₃OH^-	Methyl alcohol anion	²A^'	C_s
253	CH₃OH^-	Methyl alcohol anion	²A^'	CS eclipsed
254	CH₃SH	Methanethiol	¹A^'	C_s
255	CH₃SH⁺	Methanethiol cation	²A^"	C_s
256	H₂OH₂O	water dimer	¹A^'	C_s
257	LiCl	lithium chloride	¹Σ	C_∞v
258	NaF	sodium fluoride	¹Σ	C_∞v
259	NaCl	Sodium Chloride	¹Σ	C_∞v
260	MgF⁺	magnesium fluoride cation	¹Σ	C_∞v
261	ZnF	Zinc monofluoride	²Σ	C_∞v
262	BF	Boron monofluoride	¹Σ	C_∞v
263	ScF	Scandium monofluoride	¹Σ	C_∞v
264	GaF⁺	Gallium monofluoride cation	²Σ	C_∞v
265	CF	Fluoromethylidyne	²Π	C_∞v
266	SiF	silicon monofluoride	²Π	C_∞v
267	SiF⁺	silicon monofluoride cation	¹Σ	C_∞v
268	CBr	Carbon monobromide	²Π	C_∞v
269	NCl	nitrogen monochloride	³Σ	C_∞v
270	AsF	Arsenic monofluoride	³Σ	C_∞v
271	AsCl	Arsenic monochloride	³Σ	C_∞v
272	FO	Oxygen monofluoride	²Π	C_∞v
273	SF	Monosulfur monofluoride	²Π	C_∞v
274	SeF	Selenium monofluoride	²Π	C_∞v
275	SeCl	Selenium monochloride	²Π	C_∞v
276	F₂	Fluorine diatomic	¹Σ_g	D_∞h
277	F₂^-	flourine diatomic anion	²Σ_u	D_∞h
278	F₂⁺	flourine diatomic cation	²Π_g	D_∞h
279	ClF	Chlorine monofluoride	¹Σ⁺	C_∞v
280	Cl₂	Chlorine diatomic	¹Σ_g	D_∞h
281	Cl₂⁺	chlorine diatomic cation	²Π_g	D_∞h
282	HCF	Fluoromethylene	¹A^'	C_s
283	HCF	Fluoromethylene	³A^"	C_s
284	HOCl⁺	hypochlorous acid cation
285	ClFH⁺	Chlorine fluoride, F-protonated
286	FClH⁺	Chlorine fluoride, Cl-protonated
287	CH₂F	fluoromethyl radical	²A	C_s
288	CH₃F	Methyl fluoride	¹A₁	C_3v
289	CH₃Cl	Methyl chloride	¹A₁	C_3v
290	NH₄Cl	Ammonium chloride
291	LiNe⁺	Lithium Neon cation
292	Ne₂⁺	Neon diatomic cation	²Σ_u	D_∞h
293	Ar₂	Argon diatomic	¹S_g	D_∞h
294	Ar₂⁺	Argon diatomic cation	²Σ_u	D_∞h
295	C₃	carbon trimer	¹Σ_g	D_∞h
296	C₃	carbon trimer	¹A₁	C_2v
297	C₃H₃	cyclopropenyl radical	²A^'	C_s
298	C₃H₅	Allyl radical	²A₂	C_2v
299	C₃H₅	Allyl radical	²A^"	C_s
300	C₃H₆	Cyclopropane	¹A₁^'	D_3h
301	CH₂CHCH₃	Propene	¹A^'	C_s
302	LiCN	lithium cyanide	¹Σ	C*V LiCN
303	LiCN	lithium cyanide	¹A^'	C_s
304	LiCN	lithium cyanide	¹Σ	C*V LiNC
305	NaCN	Sodium Cyanide	¹A	C_s
306	N₃	azide radical	²Π_g	D_∞h
307	N₃⁺	azide cation	³Σ_g	D_∞h
308	N₃⁺	azide cation	³Σ	C_∞v
309	HCCN	cyanomethylene	³A^"	C_s
310	NH₂CN	cyanamide	¹A₁	C_2v
311	CH₂CHNH	vinylazine	²A^"	CS cis
312	Li₂O	dilithium oxide	¹Σ_g	D_∞h
313	Li₂S	dilithium sulfide	¹Σ_G	D_∞h
314	Li₂S	dilithium sulfide	¹A₁	C_2v
315	CCO	Dicarbon monoxide	³Σ	C_∞v
316	CCO	Dicarbon monoxide	¹Π	C_∞v
317	NCO	isocyanato radical	²Π	C_∞v
318	N₂O	Nitrous oxide	¹Σ	C_∞v
319	N₂O^-	Nitrous oxide anion	²A^'	C_s
320	CO₂	Carbon dioxide	¹Σ_g	D_∞h
321	OCS	Carbonyl sulfide	¹Σ	C_∞v
322	TiO₂	Titanium dioxide	¹A₁	C_2v
323	SiS₂	Silicon disulfide	¹Σ_G	D_∞h
324	NO₂	Nitrogen dioxide	²A₁	C_2v
325	NO₂⁺	Nitrogen dioxide cation	¹Σ_G	D_∞h
326	O₃	Ozone	¹A₁	C_s
327	SO₂	Sulfur dioxide	¹A₁	C_2v
328	S₃	Sulfur trimer	¹A₁	C_2v
329	S₃⁺	Sulfur trimer cation	²B₂	C_2v
330	HCNO	fulminic acid	¹Σ	C_∞v
331	HCNO	fulminic acid	¹A^'	C_s
332	HNNO⁺	Nitrous oxide, N-protonated	¹A^'	C_s
333	NNOH⁺	Nitrous Oxide, O-protonated	¹A^'	C_s
334	O₃H⁺	protonated ozone	¹A^'	C_s
335	Be(OH)₂	Beryllium hydroxide
336	Be(OH)₂	Beryllium hydroxide
337	H₂COO	Dioxymethyl radical	²A^'	C_s
338	HCOOH	Formic acid	¹A^'	C_s
339	CH₂BOH	hydroxy(methylene)borane	¹A^'	C_s
340	BH₃CO	Borane carbonyl	¹A₁	C_3v
341	CH₃BO	Borane, methyloxo-	¹A₁	C_3v
342	CH₃NO	nitrosomethane	¹A^'	C_s
343	CuF₂	Copper difluoride	²Π_g	D_∞h
344	CNF	iso cyanogen fluoride	¹Σ	C_∞v
345	FCO	Carbonyl fluoride	²A^'	C_s
346	FCO⁺	Carbonyl fluoride cation	¹Σ	C_∞v
347	ClCO	carbonyl monochloride	²A^'	C_s
348	FSN	Thiazyl fluoride	¹A^'	C_s
349	CF₂	Difluoromethylene	¹A₁	D_∞h
350	CFCl	chlorofluoromethylene	¹A^'	C_s
351	OClO^-	Chlorine dioxide anion	¹A^'	C_s
352	HFCO⁺	formyl fluoride cation	²A^'	C_s
353	C₄H₄	Tetrahedrane
354	Li₃N	trilithium nitride	¹A^'	D_3h
355	C₂N₂	Cyanogen	¹Σ_g	D_∞h
356	C₄H₈	cyclobutane	¹A₁	D_2d
357	C₃O	Tricarbon monoxide	¹Σ	C_∞v
358	ONNO	NO dimer	¹A_g	trans C2H
359	NH₂COOH	Carbamic acid	¹A^'	C_s
360	NH₂CONH₂	Urea	¹A₁	C_2v
361	C₃H₆O	Oxetane	¹A₁	C_2v
362	C₃H₆O	Oxetane	¹A^'	C_s
363	BF₃	Borane, trifluoro-	¹A^'	D_3h
364	NBr₃	Nitrogen Tribromide	¹A₁	C_3v
365	BrONO₂	Bromine nitrate	¹A^'	C_s
366	C₃H₃N₃O₃	cyanuric acid	¹A₁^'	D_3h

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 anion	h-
5	H⁺	Hydrogen atom cation	h+
6	D₂	Deuterium diatomic	d2
7	H₂	Hydrogen diatomic	h2
8	H₂^-	hydrogen diatomic anion	h2-
9	H₂⁺	Hydrogen cation	h2+
10	HD	Deuterium hydride	hd
11	H₃⁺	hydrogen trimer cation	h3+
12	He^-	Helium atom anion	he-
13	He⁺	Helium atom cation	he+
14	HeH	Helium hydride	heh
15	HeH⁺	Helium hydride cation	heh+
16	He₂⁺	helium diatomic cation	he2+
17	Li^-	Lithium atom anion	li-
18	Li⁺	Lithium atom cation	li+
19	Na	Sodium atom	na
20	Na^-	Sodium atom anion	na-
21	Na⁺	Sodium atom cation	na+
22	K	Potassium atom	k
23	K^-	Potassium atom anion	k-
24	K⁺	Potassium atom cation	k+
25	Cu	Copper atom	cu
26	Cu^-	Copper atom anion	cu-
27	Cu⁺	Copper atom cation	cu+
28	LiH	Lithium Hydride	lih
29	LiH^-	lithium hydride anion	lih-
30	LiH⁺	lithium hydride cation	lih+
31	NaH	sodium hydride	nah
32	NaH^-	sodium hydride anion	nah-
33	NaH⁺	sodium hydride cation	nah+
34	KH	Potassium hydride	kh
35	KH⁺	Potassium hydrogen cation	kh+
36	CuH	Copper monohydride	cuh
37	Be	Beryllium atom	be
38	Be^-	Beryllium atom anion	be-
39	Be⁺	Beryllium atom cation	be+
40	Mg	Magnesium atom	mg
41	Mg^-	Magnesium atom anion	mg-
42	Mg⁺	Magnesium atom cation	mg+
43	Ca	Calcium atom	ca
44	Ca^-	Calcium atom anion	ca-
45	Ca⁺	Calcium atom cation	ca+
46	Zn	Zinc atom	zn
47	Zn^-	Zinc atom anion	zn-
48	Zn⁺	Zinc atom cation	zn+
49	BeH	beryllium monohydride	beh
50	BeH^-	berylium monohydride anion	beh-
51	BeH⁺	beryllium monohydride cation	beh+
52	MgH^-	magnesium monohydride anion	mgh-
53	MgH⁺	magnesium monohydride cation	mgh+
54	CaH	Calcium monohydride	cah
55	CaH⁺	Calcium monohydride cation	cah+
56	TiH	Titanium monohydride	tih
57	ZnH	Zinc monohydride	znh
58	ZnH⁺	Zinc, protonated	znh+
59	BeH₂	beryllium dihydride	beh2
60	BeH₂⁺	Beryllium dihydride cation	beh2+
61	CaH₂	Calcium Hydride	cah2
62	ZnH₂	Zinc hydride	znh2
63	B^-	Boron atom anion	b-
64	B⁺	Boron atom cation	b+
65	Al	Aluminum atom	al
66	Al⁺	Aluminum atom cation	al+
67	Sc	Scandium atom	sc
68	Sc⁺	Scandium cation	sc+
69	Ga	Gallium atom	ga
70	Ga^-	Gallium atom anion	ga-
71	Ga⁺	Gallium atom cation	ga+
72	BH^-	boron monohydride anion	bh-
73	BH⁺	boron monohydride cation	bh+
74	AlH	aluminum monohydride	alh
75	AlH^-	aluminum monohydride anion	alh-
76	AlH⁺	aluminum monohydride cation	alh+
77	ScH⁺	Scandium monohydride cation	sch+
78	GaH	Gallium monohydride	gah
79	GaH⁺	Gallium monohydride cation	gah+
80	BH₂	boron dihydride	bh2
81	BH₂^-	boron dihydride anion	bh2-
82	BH₂⁺	Boron dihydride cation	bh2+
83	AlH₂	aluminum dihydride	alh2
84	AlH₂^-	aluminum dihydride anion	alh2-
85	AlH₂⁺	aluminum dihydride cation	alh2+
86	BH₃	boron trihydride	bh3
87	BH₃^-	boron trihydride anion	bh3-
88	AlH₃⁺	aluminum trihydride cation	alh3+
89	GaH₃	Gallium trihydride	gah3
90	AlH₄^-	Aluminum tetrahydride anion	alh4-
91	C^-	Carbon atom anion	c-
92	C⁺	Carbon atom cation	c+
93	Si⁺	Silicon atom cation	si+
94	Ti	Titanium atom	ti
95	Ti^-	Titanium atom anion	ti-
96	Ti⁺	Titanium atom cation	ti+
97	Ge	Germanium atom	ge
98	Ge^-	Germanium anion	ge-
99	Ge⁺	Germanium cation	ge+
100	Sn	Tin atom	sn
101	Sn⁺	Tin cation	sn+
102	CH	Methylidyne	ch
103	CH^-	methylidyne anion	ch-
104	CH⁺	Methylidyne cation	ch+
105	SiH^-	silicon monohydride anion	sih-
106	SiH₂	silicon dihydride	sih2
107	SiH₂^-	silicon dihydride anion	sih2-
108	SiH₂⁺	silicon dihydride cation	sih2+
109	GeH₂^-	germylene anion	geh2-
110	SiH₃^-	Silyl anion	sih3-
111	GeH₃	Germyl radical	geh3
112	GeH₃⁺	germyl cation	geh3+
113	CD₄	methane-d4	cd4
114	CH₂D₂	methane-d2	ch2d2
115	CH₃D	methane-d	ch3d
116	CH₄⁺	Methane cation	ch4+
117	CHD₃	methane-d3	chd3
118	SiH₄⁺	Silane cation	sih4+
119	SnH₄	Stannane	snh4
120	N^-	Nitrogen atom anion	n-
121	P^-	Phosphorus atom anion	p-
122	P⁺	Phosphorus atom cation	p+
123	Sb	Antimony atom	sb
124	NH	Imidogen	nh
125	NH^-	Imidogen anion	nh-
126	NH⁺	imidogen cation	nh+
127	PH^-	phosphorus monohydride anion	ph-
128	PH⁺	phosphorus monohydride cation	ph+
129	AsH	Arsenic monohydride	ash
130	AsH⁺	Arsenic monohydride cation	ash+
131	SbH	Antimony monohydride	sbh
132	ND₂	Amidogen-d2	nd2
133	NH₂^-	amino anion	nh2-
134	PH₂	Phosphino radical	ph2
135	PH₂^-	Phosphino anion	ph2-
136	PH₂⁺	Phosphino cation	ph2+
137	AsH₂	Arsenic dihydride	ash2
138	AsH₂⁺	Arsenic dihydride cation	ash2+
139	ND₃	Ammonia-d3	nd3
140	AsH₃	Arsine	ash3
141	AsH₃⁺	Arsine cation	ash3+
142	SbH₃	Stibine	sbh3
143	AsH₄⁺	Arsonium	ash4+
144	NH₄	Ammonium radical	nh4
145	O^-	Oxygen atom anion	o-
146	Cr	Chromium atom	cr
147	Se	Selenium atom	se
148	Se^-	Selenium atom anion	se-
149	Se⁺	Selenium atom cation	se+
150	Te	Tellurium atom	te
151	Te⁺	Tellurium atom cation	te+
152	DO	Hydroxyl-d	od
153	DS	Mercapto-d	ds
154	CrH	Chromium hydride	crh
155	HSe	Selenium monohydride	hse
156	HSe^-	selenium monohydride anion	hse-
157	TeH	Telluryl radical	teh
158	D₂O	Deuterium oxide	d2o
159	D₂S	Hydrogen sulfide-d2	d2s
160	H₂S^-	Hydrogen sulfide anion	h2s-
161	H₂Se⁺	Hydrogen selenide cation	h2se+
162	H₂Te	Hydrogen Telluride	h2te
163	Mn	Manganese atom	mn
164	Br	Bromine atom	br
165	Br^-	Bromine atom anion	br-
166	Br⁺	Bromine atom cation	br+
167	I	Iodine atom	iodine
168	I^-	Iodine atom anion	iodine-
169	I⁺	Iodine atom cation	iodine+
170	DF	Hydrofluoric acid-d	df
171	HF^-	hydrogen fluoride anion	hf-
172	HF⁺	hydrogen fluoride cation	hf+
173	DCl	Hydrochloric acid-d	dcl
174	HCl^-	hydrogen chloride anion	hcl-
175	HBr^-	hydrogen bromide anion	hbr-
176	HBr⁺	hydrogen bromide cation	hbr+
177	HI	Hydrogen iodide	hi
178	HI⁺	Hydrogen iodide cation	hi+
179	H₂F⁺	dihydrogen fluoride cation	h2f+
180	H₂I⁺	Iodonium	h2i+
181	Ne^-	Neon atom anion	ne-
182	Ar^-	Argon atom anion	ar-
183	Ar⁺	Argon atom cation	ar+
184	Fe	Iron atom	fe
185	Xe	Xenon atom	xe
186	HeLi⁺	Helium Lithium cation	heli+
187	NeH	neon hydrogen	neh
188	NeH⁺	neon hydrogen cation	neh+
189	XeH⁺	Xenon, protonated	xeh+
190	H₂Ar	H2 Ar dimer	h2ar
191	Co	Cobalt atom	cobalt
192	Ni	Nickel atom	ni
193	Li₂	Lithium diatomic	li2
194	Li₂^-	lithium diatomic anion	li2-
195	Li₂⁺	lithium diatomic cation	li2+
196	NaLi	lithium sodium	lina
197	NaLi^-	lithium sodium anion	lina-
198	NaLi⁺	lithium sodium cation	lina+
199	LiK	Lithium Potassium	lik
200	Na₂	Sodium diatomic	na2
201	Na₂^-	sodium diatomic anion	na2-
202	NaK	Sodium Potassium	nak
203	NaK⁺	Sodium Potassium diatomic cation	nak+
204	K₂	Potassium diatomic	k2
205	Cu₂	Copper diatomic	cu2
206	LiBe	Lithium Beryllium	libe
207	LiMg	Lithium magnesium	limg
208	NaBe	Sodium Beryllium	nabe
209	NaMg	Sodium Magnesium	namg
210	Be₂	Beryllium diatomic	be2
211	Be₂^-	Beryllium diatomic anion	be2-
212	Be₂⁺	Beryllium diatomic cation	be2+
213	Mg₂	Magnesium diatomic	mg2
214	Mg₂^-	magnesium diatomic anion	mg2-
215	Mg₂⁺	magnesium diatomic cation	mg2+
216	Ca₂	Calcium diatomic	ca2
217	LiB	Lithium boride	lib
218	LiAl	Lithium Aluminum	lial
219	B₂	Boron diatomic	b2
220	B₂^-	Boron diatomic anion	b2-
221	Al₂	Aluminum diatomic	al2
222	Al₂^-	aluminum diatomic anion	al2-
223	Al₂⁺	aluminum diatomic cation	al2+
224	LiBH₄	Lithium borohydride	libh4
225	Al₂H₆	dialane	al2h6
226	LiC	Lithium Carbide	lic
227	BC	boron monocarbide	bc
228	BC^-	boron monocarbide anion	bc-
229	BC⁺	boron monocarbide cation	bc+
230	C₂^-	carbon diatomic anion	c2-
231	SiC	silicon monocarbide	sic
232	SiC^-	silicon monocarbide anion	sic-
233	SiC⁺	silicon monocarbide cation	sic+
234	Si₂	Silicon diatomic	si2
235	Si₂^-	silcon diatomic anion	si2-
236	Si₂⁺	silcon diatomic cation	si2+
237	GeC	Germanium monocarbide	gec
238	Ge₂	Germanium diatomic	ge2
239	C₂H^-	Ethynyl anion	c2h-
240	C₂H⁺	Ethynyl cation	c2h+
241	ZnCH₂	Zinc methylene	znch2
242	CCH₂	vinylidene	vinylidene
243	HCCH^-	acetylene anion	c2h2-
244	Si₂H₂	disilyne	si2h2
245	CuCH₃	monomethyl copper	cuch3
246	ZnCH₃	Zinc monomethyl	znch3
247	C₂H₃⁺	vinyl cation	c2h3+
248	CH₃CH	methylmethylene	ch3ch
249	CH₂SiH₂	silaethylene	ch2sih2
250	Si₂H₄	Disilene	si2h4
251	C₂H₅^-	Ethyl anion	c2h5-
252	C₂H₅⁺	Ethyl cation	c2h5+
253	C₂H₆⁺	ethane cation	c2h6+
254	CH₃SiH₃	methyl silane	ch3sih3
255	Si₂H₆	disilane	si2h6
256	GeH₃CH₃	methyl germane	geh3ch3
257	C₂H₇⁺	Ethane, protonated	c2h7+
258	LiN	Lithium Nitride	lin
259	LiN⁺	Lithium Nitride cation	lin+
260	BeN	Beryllium mononitride	ben
261	BeN^-	Beryllium mononitride anion	ben-
262	MgN	Magnesium Nitride	mgn
263	BN^-	boron nitride anion	bn-
264	AlN^-	aluminum mononitride anion	aln-
265	AlN⁺	aluminum mononitride cation	aln+
266	GaN	Gallium mononitride	gan
267	BN⁺	boron nitride cation	bn+
268	AlN	Aluminum nitride	aln
269	CN⁺	Cyano cation	cn+
270	CP	Carbon monophosphide	cp
271	CP^-	carbon monophosphide anion	cp-
272	CP⁺	carbon monophosphide cation	cp+
273	SiN	Silicon nitride	sin
274	SiN^-	silicon mononitride anion	sin-
275	SiN⁺	silicon mononitride cation	sin+
276	SiP^-	Silicon monophosphide anion	sip-
277	SiP⁺	Silicon monophosphide cation	sip+
278	TiN	Titanium mononitride	tin
279	N₂⁺	diatomic nitrogen cation	n2+
280	PN	Phosphorus mononitride	pn
281	PN^-	phosphorus nitride anion	pn-
282	PN⁺	phosphorus nitride cation	pn+
283	P₂	Phosphorus diatomic	p2
284	P₂^-	phosphorus diatomic anion	p2-
285	P₂⁺	phosphorus diatomic cation	p2+
286	AsN	Arsenic mononitride	asn
287	AsP	Arsenic monophosphide	asp
288	SbN	Antimony nitride	sbn
289	As₂	Arsenic diatomic	as2
290	HNB	hydrogen nitrogen boron	hnb
291	HNC	hydrogen isocyanide	hnc
292	HCN^-	Hydrogen cyanide anion	hcn-
293	HCP	Phosphaethyne	hcp
294	HCP⁺	Phosphaethyne cation	hcp+
295	NNH	Dinitrogen monohydride	nnh
296	HPO	Hydrogen phosphorus oxide	hpo
297	HPO⁺	Hydrogen phosphorus oxide cation	hpo+
298	LiNH₂	lithium amide	linh2
299	HBNH	Boranimine	hbnh
300	CNH₂	Aminomethylidyne radical	cnh2
301	CNH₂⁺	N-protonated hydrogen isocyanide	cnh2+
302	H₂CN	Dihydrogen cyanide radical	h2cn
303	H₂CN⁺	hydrocyanonium cation	h2cn+
304	HCNH	methyleneazane	hcnh
305	HCNH⁺	N-protonated HCN	hcnh+
306	H₂NN	Isodiazene	h2nn
307	CH₂NH	Methanimine	ch3n
308	CHNH₂	aminomethylene	chnh2
309	CHNH₂⁺	Aminocarbene cation	chnh2+
310	CH₂PH	Phosphaethene	ch3p
311	BH₂NH₂	Boranamine	bh2nh2
312	N₂H₄	Hydrazine	n2h4
313	P₂H₄	Diphosphine	p2h4
314	CH₃PH₂	Methyl phosphine	ch3ph2
315	SiH₃NH₂	Silane, amino	sih3nh2
316	N₂H₅⁺	protonated hydrazine	n2h5+
317	BH₃NH₃	borane ammonia	bh3nh3
318	CH₃NH₃	methyl ammonium radical	ch3nh3
319	CH₃NH₃⁺	protonated methylamine	ch3nh3+
320	CH₃PH₃⁺	methyl phosphine, protonated	ch3ph3+
321	LiO^-	lithium oxide anion	lio-
322	LiO⁺	lithium oxide cation	lio+
323	NaO^-	sodium oxide anion	nao-
324	NaO⁺	sodium oxide cation	nao+
325	KO	Potassium monoxide	ko
326	KO⁺	Potassium monoxide cation	ko+
327	CuO	Copper Monoxide	cuo
328	LiSe	Lithium monoselenide	lise
329	BeO	beryllium oxide	beo
330	BeO^-	Beryllium monoxide anion	beo-
331	BeO⁺	Beryllium monoxide cation	beo+
332	BeS	beryllium sulfide	bes
333	MgO	magnesium oxide	mgo
334	MgO^-	magnesium oxide anion	mgo-
335	MgO⁺	magnesium oxide cation	mgo+
336	CaO	Calcium monoxide	cao
337	MgS	magnesium sulfide	mgs
338	MgS^-	magnesium sulfide anion	mgs-
339	MgS⁺	magnesium sulfide cation	mgs+
340	ZnO	zinc monoxide	zno
341	ZnS	Zinc sulfide	zns
342	BeS^-	Beryllium monosulfide anion	bes-
343	BeS⁺	Beryllium monosulfide cation	bes+
344	BO^-	boron monoxide anion	bo-
345	AlO	Aluminum monoxide	alo
346	AlO^-	Aluminum monoxide anion	alo-
347	AlO⁺	aluminum monoxide cation	alo+
348	BS	boron sulfide	bs
349	BS^-	boron monosulfide anion	bs-
350	BS⁺	boron monosulfide cation	bs+
351	AlS	Aluminum sulfide	als
352	AlS^-	aluminum monosulfide anion	als-
353	AlS⁺	aluminum monosulfide cation	als+
354	GaO	Gallium monoxide	gao
355	GaS	Gallium monosulfide	gas
356	BO⁺	boron monoxide cation	bo+
357	CS	carbon monosulfide	cs
358	CS^-	carbon monosulfide anion	cs-
359	CS⁺	carbon monosulfide cation	cs+
360	SiO	Silicon monoxide	sio
361	SiO^-	silicon monoxide anion	sio-
362	SiO⁺	silicon monoxide cation	sio+
363	SiS	silicon monosulfide	sis
364	SiS^-	silicon monosulfide anion	sis-
365	SiS⁺	silicon monosulfide cation	sis+
366	CSe	Carbon monoselenide	cse
367	CSe^-	Carbon monoselenide anion	cse-
368	CSe⁺	Carbon monoselenide cation	cse+
369	GeO	Germanium monoxide	geo
370	GeSe	Germanium monoselenide	gese
371	NS^-	nitrogen sulfide anion	ns-
372	NS⁺	nitrogen sulfide cation	ns+
373	PO^-	phosphorus monoxide anion	po-
374	PO⁺	phosphorus monoxide cation	po+
375	PS^-	phosphorus monosulfide anion	ps-
376	PS⁺	phosphorus monosulfide cation	ps+
377	AsO	Arsenic monoxide	aso
378	O₂^--	dioxygen dianion	o2--
379	O₂⁺	diatomic oxygen cation	o2+
380	SO	Sulfur monoxide	so
381	SO^-	sulfur monoxide anion	so-
382	S₂^-	sulfur diatomic anion	s2-
383	S₂⁺	sulfur diatomic cation	s2+
384	SeO	Selenium monoxide	seo
385	SeO^-	selenium monoxide anion	seo-
386	SeO⁺	selenium monoxide cation	seo+
387	SeS	Selenium monosulfide	ses
388	SeS^-	selenium monosulfide anion	ses-
389	SeS⁺	selenium monosulfide cation	ses+
390	TeO	Tellurium monoxide	teo
391	Se₂	Selenium diatomic	se2
392	Se₂^-	selenium diatomic anion	se2-
393	Se₂⁺	selenium diatomic cation	se2+
394	Te₂	Tellurium diatomic	te2
395	NaOH	sodium hydroxide	naoh
396	KOH	Potassium hydroxide	koh
397	MgOH	magnesium hydroxide	mgoh
398	CaOH	Calcium monohydroxide	caoh
399	HBS	hydrogen boron sulfide	hbs
400	HCO	Formyl radical	hco
401	HCO⁺	Formyl cation	hco+
402	HCS	Thioformyl radical	hcs
403	HCS^-	Thioformyl anion	hcs-
404	HCS⁺	Thioformyl cation	hcs+
405	HNO	Nitrosyl hydride	hno
406	HNO^-	Nitrosyl hydride anion	hno-
407	HNS	Sulfur imide	hns
408	HNS^-	Sulfur imide anion	hns-
409	HO₂^-	Hydroperoxy anion	ho2-
410	SOH	Sulfur Hydroxide	soh
411	HS₂	Thiosulfeno radical	hs2
412	HOCH	hydroxycarbene	hoch
413	H₂CS^-	thioformaldehyde anion	h2cs-
414	H₂CS⁺	thioformaldehyde cation	h2cs+
415	H₂CSe	Selenoformaldehyde	h2cse
416	H₂O₂⁺	Hydrogen peroxide cation	h2o2+
417	H₂OO	water oxide	h2oo
418	HOSH	hydrogen thioperoxide	hosh
419	H₂Se₂	hydrogen diselenide	h2se2
420	CH₂OH⁺	hydroxymethyl cation	ch2oh+
421	CH₃O	Methoxy radical	ch3o
422	CH₃O^-	methoxy anion	ch3o-
423	CH₃S	thiomethoxy	ch3s
424	H₂CSH⁺	Thioformaldehyde, protonated	h2csh+
425	NH₃O	Ammonia Oxide	nh3o
426	H₂POH	Phosphinous acid	h2poh
427	H₃PO	Phosphine oxide	h3po
428	NH₂SH	Thiohydroxylamine	nh2sh
429	NH₃S	sulfidoazane	nh3s
430	H₃O₂⁺	hydrogen peroxide, protonated	h3o2+
431	CH₃OH	Methyl alcohol	ch3oh
432	CH₃OH⁺	Methyl alcohol cation	ch3oh+
433	SiH₃OH	silanol	sih3oh
434	CH₃SeH	Methane selenol	ch3seh
435	NH₂OH₂⁺	protonated hydroxylamine	nh2oh2+
436	NH₃OH⁺	N-protonated hydroxylamine	nh3oh+
437	CH₃OH₂⁺	Methanol, protonated	ch3oh2+
438	CH₃SH₂⁺	protonated methylsulfide	ch3sh2+
439	H₂ONH₃	Water Ammonia Dimer	h2onh3
440	H₅O₂⁺	Dihydroxonium ion	h5o2+
441	LiF	lithium fluoride	lif
442	LiCl^-	lithium chloride anion	licl-
443	LiCl⁺	lithium chloride cation	licl+
444	NaF^-	sodium fluoride anion	naf-
445	NaF⁺	sodium fluoride cation	naf+
446	KF	Potassium Fluoride	kf
447	NaCl^-	sodium chloride anion	nacl-
448	NaCl⁺	sodium chloride cation	nacl+
449	KCl	Potassium Chloride	kcl
450	CuF	Copper monofluoride	cuf
451	LiBr	Lithium Bromide	libr
452	LiBr^-	lithium bromide anion	libr-
453	LiBr⁺	lithium bromide cation	libr+
454	CuCl	Copper monochloride	cucl
455	NaBr	Sodium Bromide	nabr
456	NaBr^-	sodium bromide anion	nabr-
457	NaBr⁺	sodium bromide cation	nabr+
458	KBr	Potassium Bromide	kbr
459	LiI	Lithium Iodide	lii
460	NaI	Sodium Iodide	nai
461	KI	Potassium Iodide	ki
462	LiF^-	lithium fluoride anion	lif-
463	LiF⁺	lithium fluoride cation	lif+
464	BeF	Beryllium monofluoride	bef
465	BeF^-	Beryllium monofluoride anion	bef-
466	BeF⁺	Beryllium monofluoride cation	bef+
467	BeCl	beryllium monochloride	becl
468	MgF	Magnesium monofluoride	mgf
469	MgF^-	magnesium fluoride anion	mgf-
470	CaF	Calcium monofluoride	caf
471	MgCl	magnesium monochloride	mgcl
472	MgCl^-	magnesium monochloride anion	mgcl-
473	MgCl⁺	magnesium monochloride cation	mgcl+
474	CaCl	calcium monochloride	cacl
475	TiCl	Titanium Monochloride	ticl
476	ZnF^-	Zinc monofluoride anion	znf-
477	ZnF⁺	Zinc monofluoride cation	znf+
478	ZnCl	Zinc monochloride	zncl
479	CaBr	Calcium monobromide	cabr
480	BeCl^-	beryllium monochloride anion	becl-
481	BeCl⁺	beryllium monochloride cation	becl+
482	BF^-	Boron monofluoride anion	bf-
483	BF⁺	Boron monofluoride cation	bf+
484	AlF	Aluminum monofluoride	alf
485	AlF^-	Aluminum monofluoride anion	alf-
486	AlF⁺	Aluminum monofluoride cation	alf+
487	BCl	boron monochloride	bcl
488	BCl^-	boron monochloride anion	bcl-
489	BCl⁺	boron monochloride cation	bcl+
490	AlCl	Aluminum monochloride	alcl
491	AlCl^-	aluminum monochloride anion	alcl-
492	AlCl⁺	aluminum monochloride cation	alcl+
493	BBr	Boron monobromide	bbr
494	GaF	Gallium monofluoride	gaf
495	AlBr	Aluminum monobromide	albr
496	GaCl	Gallium monochloride	gacl
497	GaCl⁺	Gallium monochloride cation	gacl+
498	AlI	Aluminum monoiodide	ali
499	GaBr	Gallium monobromide	gabr
500	CF^-	carbon monofluoride anion	cf-
501	CF⁺	carbon monofluoride cation	cf+
502	CCl	carbon monochloride	ccl
503	CCl^-	carbon monochloride anion	ccl-
504	CCl⁺	carbon monochloride cation	ccl+
505	SiF^-	silicon monofluoride anion	sif-
506	SiCl	Clorosilylidyne	sicl
507	SiCl^-	silicon monochloride anion	sicl-
508	SiCl⁺	silicon monochloride cation	sicl+
509	GeF	Germanium monofluoride	gef
510	GeF⁺	Germanium monofluoride cation	gef+
511	GeCl	Germanium monochloride	gecl
512	GeCl⁺	Germanium monochloride cation	gecl+
513	SiBr	Silicon monobromide	sibr
514	SiBr⁺	Silicon monobromide cation	sibr+
515	NF	nitrogen fluoride	nf
516	NF^-	nitrogen monofluorine anion	nf-
517	NF⁺	nitrogen monofluoirde cation	nf+
518	NCl^-	nitrogen monochloride anion	ncl-
519	NCl⁺	nitrogen monochloride cation	ncl+
520	PF	phosphorus monofluoride	pf
521	PF^-	phosphorus monofluoride anion	pf-
522	PF⁺	phosphorus monofluoride cation	pf+
523	PCl	phosphorus chloride	pcl
524	PCl^-	phosphorus monochloride anion	pcl-
525	PCl⁺	phosphorus monochloride cation	pcl+
526	NBr	nitrogen monobromide	nbr
527	PBr	Phosphorus monobromide	pbr
528	SbF	Antimony monofluoride	sbf
529	SbCl	Antimony monochloride	sbcl
530	FO^-	flourine oxide anion	fo-
531	FO⁺	fluorine monoxide cation	fo+
532	ClO	Monochlorine monoxide	clo
533	ClO^-	chlorine monoxide anion	clo-
534	ClO⁺	chlorine monoxide cation	clo+
535	SF^-	sulfur monofluoride anion	sf-
536	SF⁺	sulfur monofluoride cation	sf+
537	SCl	sulfur monochloride	scl
538	SCl^-	sulfur monochloride anion	scl-
539	SCl⁺	sulfur monochloride cation	scl+
540	BrO	Bromine monoxide	bro
541	BrO^-	Bromine monoxide anion	bro-
542	BrO⁺	Bromine monoxide cation	bro+
543	SBr	Sulfur monobromide radical	sbr
544	SBr⁺	Sulfur monobromide cation	sbr+
545	IO	Iodine monoxide	io
546	SeBr	Selenium monobromide	sebr
547	BrCl	Bromine monochloride	brcl
548	ClF^-	clorine monofluoride anion	clf-
549	ClF⁺	clorine monofluoride cation	clf+
550	Cl₂^-	chlorine diatomic anion	cl2-
551	BrF	Bromine monofluoride	brf
552	BrF^-	bromine fluoride anion	brf-
553	BrF⁺	bromine fluoride cation	brf+
554	BrCl^-	bromine chloride anion	brcl-
555	BrCl⁺	bromine chloride cation	brcl+
556	IF	Iodine monofluoride	if
557	Br₂	Bromine diatomic	br2
558	Br₂^-	bromine diatomic anion	br2-
559	Br₂⁺	bromine diatomic cation	br2+
560	ICl	Iodine monochloride	icl
561	IBr	Iodine monobromide	ibr
562	I₂	Iodine diatomic	i2
563	I₂⁺	Iodine diatomic cation	i2+
564	HCCl	Chloromethylene	hccl
565	HSiF	fluorosilylene	hsif
566	HSiCl	Chlorosilylene	hsicl
567	HSiBr	monobromosilylene	hsibr
568	CHBr	bromomethylene	chbr
569	HOF	Hypofluorous acid	hfo
570	DOCl	Hypochlorous acid-d	docl
571	HOCl	hypochlorous acid	hocl
572	HOBr	Hypobromous acid	hobr
573	HOBr⁺	Hypobromous acid cation	hobr+
574	HOI	Hypoiodous acid	hoi
575	F₂H⁺	Fluorine, protonated	f2h+
576	FHF	Hydrogen difluoride	fhf
577	FHF^-	Hydrogen difluoride anion	fhf-
578	Cl₂H⁺	Chlorine, protonated	cl2h+
579	CH₂Br	bromomethyl radical	ch2br
580	CH₂F⁺	fluoromethyl cation	ch2f+
581	CH₂Cl⁺	chloromethyl cation	ch2cl+
582	CH₂Cl	chloromethyl radical	ch2cl
583	NH₂F	monofluoroamine	nh2f
584	NH₂Cl	chloramine	nh2cl
585	H₂F₂	Hydrogen fluoride dimer	h2f2
586	CH₃F⁺	methyl fluoride cation	ch3f+
587	CD₃F	methylfluoride-d3	cd3f
588	CD₃Cl	methyl chloride d3	cd3cl
589	CH₃Cl⁺	Methyl chloride cation	ch3cl+
590	SiH₃F	monofluorosilane	sih3f
591	SiH₃Cl	chlorosilane	sih3cl
592	CH₃Br	methyl bromide	ch3br
593	GeH₃F	monofluorogermane	geh3f
594	GeH₃Cl	monochlorogermane	geh3cl
595	SiH₃Br	bromosilane	sih3br
596	CH₃I	methyl iodide	ch3i
597	SiH₃I	Silyl Iodide	sih3i
598	NH₃Cl⁺	protonated monochloroammonia	nh3cl+
599	CH₃ClH⁺	methyl chloride, protonated	ch3clh+
600	Ne₂	Neon diatomic	ne2
601	Li₃	Lithium trimer	li3
602	Li₃⁺	Lithium trimer cation	li3+
603	C₃⁺	carbon trimer cation	c3+
604	SiC₂	Silicon dicarbide	sic2
605	C₃H₃	Propargyl radical	propargyl
606	C₃H₃^-	Propargyl anion	c3h3-
607	C₃H₃⁺	cyclopropenyl cation	cpr+
608	C₃H₃⁺	Propargyl cation	c3h3+
609	C₃H₄	cyclopropene	cprop
610	CH₂CCH₂	allene	allene
611	CH₃CCH	propyne	propyne
612	C₃H₅⁺	Allyl cation	allyl+
613	CH₃CHCH	1-propenyl radical	ch3chch
614	Zn(CH₃)₂	dimethyl zinc	dmz
615	C₃H₇	n-Propyl radical	npropyl
616	C₃H₇⁺	cyclopropane, protonated	c3h7+
617	CH₃CHCH₃	Isopropyl radical	isopropyl
618	CH₃CHCH₃⁺	Isopropyl cation	prop2yl+
619	C₃H₈	Propane	propane
620	SiH₂(CH₃)₂	dimethylsilane	dms
621	Si₃H₈	trisilane	si3h8
622	KCN	Potassium cyanide	kcn
623	CuCN	Copper cyanide	cucn
624	ZnCN	Zinc monocyanide	zncn
625	ZnNC	Zinc isocyanide	znnc
626	AlCN	Aluminum monocyanide	alcn
627	AlNC	Aluminum isocyanide	alnc
628	CN₂	3H-Diazirin-3-ylidene	cn2
629	CNN	Diazocarbene	cnn
630	NCN	Cyanoimidogen	ncn
631	N₃^-	azide anion	n3-
632	HCNN	diazomethyl radical	hcnn
633	HN₃	hydrogen azide	hn3
634	HN₃⁺	Hydrazoic acid cation	hn3+
635	HNCNH	diiminomethane	hncnh
636	CH₂N₂	diazirine	ch2n2
637	CH₂NN	diazomethane	ch2nn
638	HNNNH⁺	1,2-Triazadienium	n2h3+
639	NH₂NN⁺	hydrazoic acid, protonated	nh2nn+
640	CH₃CN	Acetonitrile	ch3cn
641	CH₃CN^-	acetonitrile anion	ch3cn-
642	CH₃CN⁺	Acetonitrile cation	ch3cn+
643	CH₃NC	methyl isocyanide	ch3nc
644	CHNCH₂	2H-Azirine	c157164
645	CHNHCH	1H-Azirine	chnhch
646	H₂CCNH	Ethenimine	ch2cnh
647	H₂CNCH	methyleneaminomethylene	ch2nch
648	HCCNH₂	Ethynamine	hccnh2
649	HCNCH₂⁺	2H-Azirine cation	hcnch2+
650	HNCNH₂⁺	diiminomethane, protonated	hncnh2+
651	NCNH₃⁺	Cyanamide, protonated	ncnh3+
652	NH₂CNH⁺	cyanamide, cn protonated	nh2cnh+
653	NH₃CN⁺	cyanamide, amine protonated	nh3cn+
654	CH₃CHN	methylmethaniminyl radical	ch3chn
655	NHCHNH₂	aminomethanimine	cn2h4
656	C₂H₅N	Aziridine	c2h5n
657	CH₂CHNH₂	aminoethene	aminoethene
658	CH₂NCH₃	N-methylmethanimine	nmm
659	CH₃CHNH	ethanimine	ethanimine
660	NH₂BHNH₂	diaminoborane	nh2bhnh2
661	C₂H₅NH⁺	Protonated Aziridine	c2h5nh+
662	C₂H₆N⁺	aziridine, protonated	c2h6n+
663	NH₂CH₂NH₂	diaminomethane	nh2ch2nh2
664	CH₃CH₂NH₂	Ethylamine	etam
665	CH₃NHCH₃	Dimethylamine	ch3nhch3
666	CH₃PHCH₃	dimethylphosphine	ch3phch3
667	NH₂CH₂NH₃⁺	diaminoethane, protonated	pdam
668	(CH₃)₂NH₂⁺	dimethylammonium cation	dmam
669	CH₃CH₂NH₃⁺	ethylamine, protonated	pea
670	Li₂O⁺	dilithium oxide cation	li2o+
671	Na₂O	disodium monoxide	na2o
672	Na₂S	Sodium sulfide	na2s
673	LiO₂	Lithium dioxide	lio2
674	NaO₂	Sodium superoxide	nao2
675	CNO^-	fulminate	cno-
676	NCO^-	cyanate	nco-
677	SCN	thiocyanato radical	scn
678	SCN^-	thiocyanide anion	scn-
679	BO₂	Boron dioxide	bo2
680	BO₂^-	Boron dioxide anion	bo2-
681	BO₂⁺	Boron dioxide cation	bo2+
682	N₂O⁺	Nitrous oxide cation	n2o+
683	NNS	Nitrogen sulfide	nns
684	PPO	Phosphorus oxide phosphide	ppo
685	CO₂^-	Carbon dioxide anion	co2-
686	CO₂⁺	Carbon dioxide cation	co2+
687	OCS⁺	Carbonyl sulfide cation	cos+
688	SiO₂	silicon dioxide	sio2
689	CS₂	Carbon disulfide	cs2
690	CS₂^-	Carbon disulfide anion	cs2-
691	CS₂⁺	Carbon disulfide cation	cs2+
692	GeO₂	Germanium dioxide	geo2
693	OCSe	Carbonyl selenide	ocse
694	SCSe	Carbon sulfide selenide	scse
695	GeS₂	Germanium disulfide	ges2
696	CSe₂	Carbon diselenide	cse2
697	SCTe	Carbon sulfide Telluride	scte
698	NO₂^-	Nitrogen dioxide anion	no2-
699	NSO	sulfinyl amidogen	NSO
700	PO₂	Phosphorus dioxide	po2
701	PO₂^-	Phosphorus dioxide anion	po2-
702	PO₂⁺	Phosphorus dioxide cation	po2+
703	SNO	Nitrogen oxide sulfide	sno
704	AsO₂	Aresenic dioxide	aso2
705	O₃^-	Ozone anion	o3-
706	O₃⁺	Ozone cation	o3+
707	SO₂^-	Sulfur dioxide anion	so2-
708	SO₂⁺	Sulfur dioxide cation	so2+
709	SSO	Disulfur monoxide	sso
710	S₃^-	Sulfur trimer anion	s3-
711	SeO₂	Selenium dioxide	seo2
712	SeO₂⁺	Selenium dioxide cation	seo2+
713	TeO₂	Tellurium Dioxide	teo2
714	HCCO	ketenyl radical	ketenyl
715	CS₂H⁺	Carbon disulfide, protonated	cs2h+
716	HNCO	Isocyanic acid	hnco
717	HOCN	cyanic acid	hocn
718	HNCS	Isothiocyanic acid	hncs
719	HSCN	thiocyanic acid	hscn
720	HCO₂^-	formate anion	hco2-
721	HNNO	nitrosoazane	hnno
722	HCOO	formate neutral radical	hcoo
723	HOCO	Hydrocarboxyl radical	hoco
724	HOCO⁺	Hydrocarboxyl cation	hoco+
725	HNO₂	Nitrous acid	hno2
726	HNO₂⁺	nitrous acid cation	hno2+
727	SO₂H⁺	protonated sulfur dioxide	so2h+
728	C₂H₂O	Oxirene	oxirene
729	CH₂CO	Ketene	ch2co
730	CH₂CO⁺	Ketene cation	ch2co+
731	HCCOH	ethynol	hccoh
732	CH₂CS	Thioketene	ch2cs
733	Mg(OH)₂	Magnesium dihydroxide	h2mgo2
734	NH₂NO	Nitrosamide	nh2no
735	CH₂O₂	Dioxirane	diox
736	H₂COO⁺	dioxymethyl cation	h2coo+
737	H₂O₃	Hydrogen trioxide	h2o3
738	HSSSH	trisulfane	hsssh
739	NaOCH₃	Sodium methoxide	naoch3
740	CH₂CHO	Vinyloxy radical	ch2cho
741	CH₂COH⁺	ketene, protonated	ch2coh+
742	CH₃CO	Acetyl radical	ch3co
743	CH₃CO^-	Acetyl anion	ch3co-
744	CH₃CO⁺	acetyl cation	ch3co+
745	CH₂NOH	formaldoxime	ch2noh
746	CHONH₂	formamide	formamide
747	CNOH₃	1,2-oxaziridine	cnoh3
748	HOCHNH	hydroxymethylimine	hochnh
749	CHSNH₂	thioformamide	chsnh2
750	NHCHSH	Methanimidothioic acid	nhchsh
751	CH₂OOH	CH2OOH radical	ch2ooh
752	CH₃OO	methylperoxy radical	ch3oo
753	CH₃OO^-	methylperoxy anion	ch3oo-
754	CH₃OO⁺	methylperoxy cation	ch3oo+
755	C₂H₄O	Ethylene oxide	c2h4o
756	C₂H₄O⁺	ethylene oxide cation	c2h4o+
757	CH₂CHOH	ethenol	ch2choh
758	CH₃CHO	Acetaldehyde	ch3cho
759	CH₃CHO⁺	acetaldehyde cation	ch3cho+
760	H₂COCH₂⁺	Methyl, (methyleneoxoniumyl)-	h2coch2+
761	C₂H₄S	Thiirane	thiirane
762	CH₂CHSH	Ethenethiol	ch2chsh
763	CH₃CHS	Thioacetaldehyde	ch3chs
764	H₂CONH₂⁺	protonated formamide	h2conh2+
765	NH₂CHOH⁺	Formamide, O-protonated	nh2choh+
766	NH₃CHO⁺	Formamide, N-Protonated	nh3cho+
767	CH₂(OH)₂	methanediol	ch2o2h2
768	CH₃OOH	Methyl peroxide	ch3ooh
769	CH₃SSH	Hydrogen methyl disulfide	ch3ssh
770	HSCH₂SH	Methanedithiol	ch4s2
771	H₂OH₂CO	water formaldehyde dimer	h2oh2co
772	C₂H₄OH⁺	ethylene oxide, protonated	c2h4oh+
773	CH₂CH₂OH	2-hydroxy ethyl radical	ch2ch2oh
774	CH₃CH₂O	Ethoxy radical	ethoxy
775	CH₃CHOH	1-hydroxy-ethyl radical	ch3choh
776	CH₃CHOH⁺	acetaldehyde, protonated	ch3choh+
777	CH₃OCH₂	methoxymethyl radical	ch3och2
778	NH₂CH₂OH	aminomethanol	nh2ch2oh
779	CH₃CH₂OH	Ethanol	etoh
780	CH₃OCH₃	Dimethyl ether	meome
781	CH₃CH₂SH	ethanethiol	etsh
782	CH₃SCH₃	Dimethyl sulfide	mesme
783	CH₃SCH₃⁺	dimethyl sulfide cation	mesme+
784	CH₃SeCH₃	dimethylselenide	dmse
785	CH₃OHH₂O	methanol water dimer	ch3ohh2o
786	H₂OCH₃OH	water methanol dimer	h2och3oh
787	ZnF₂	Zinc difluoride	znf2
788	FCN	Cyanogen fluoride	fcn
789	ClCN	chlorocyanogen	clcn
790	BrCN	Cyanogen bromide	brcn
791	ICN	Cyanogen iodide	icn
792	FBO	Boron monofluoride monoxide	fbo
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	BeBr₂	Beryllium bromide	bebr2
800	CaBr₂	Calcium dibromide	cabr2
801	CaF₂	Calcium difluoride	caf2
802	BF₂	Boron difluoride radical	bf2
803	FNO	Nitrosyl fluoride	fno
804	ClNO	Nitrosyl chloride	clno
805	FNS	Thionitrosyl fluoride	fns
806	OPCl	Phosphorus oxychloride	opcl
807	BrNO	Nitrosyl bromide	brno
808	INO	Nitrosyl iodide	ino
809	CF₂^-	Difluoromethylene anion	cf2-
810	CF₂⁺	Difluoromethylene cation	cf2+
811	SiF₂	Silicon difluoride	sif2
812	SiF₂⁺	Silicon difluoride cation	sif2+
813	CCl₂	dichloromethylene	ccl2
814	CCl₂^-	dichloromethylene anion	ccl2-
815	CCl₂⁺	dichloromethylene cation	ccl2+
816	SiCl₂	Dichlorosilylene	sicl2
817	GeF₂	Germanium difluoride	gef2
818	GeCl₂	Germanium dichloride	gecl2
819	CBr₂	dibromomethylene	cbr2
820	FOO	Dioxygen monofluoride radical	foo
821	FOO⁺	Fluorine dioxide cation	foo+
822	ClOO	chloroperoxy radical	cloo
823	ClOO⁺	chloroperoxy cation	cloo+
824	OClO	Chlorine dioxide	oclo
825	OClO⁺	Chlorine dioxide cation	oclo+
826	ClSO	Sulfur chloride oxide	clso
827	ClS₂	Sulfur chloride	cls2
828	BrOO	Bromine dioxide	broo
829	OBrO	Bromine dioxide radical	obro
830	NF₂	Difluoroamino radical	nf2
831	NF₂⁺	Difluoroamino cation	nf2+
832	PF₂	Phosphorus difluoride	pf2
833	PF₂⁺	Phosphorus difluoride cation	pf2+
834	FClO	chlorosyl fluoride	fclo
835	F₂O	Difluorine monoxide	f2o
836	ClOF	Chlorine hypofluorite	clof
837	SF₂	sulfur difluoride	sf2
838	SF₂^-	sulfur difluoride anion	sf2-
839	SF₂⁺	sulfur difluoride cation	sf2+
840	Cl₂O	Dichlorine monoxide	cl2o
841	SCl₂	Sulfur dichloride	scl2
842	SeF₂	Selenium difluoride	sef2
843	BrOCl	Bromine hypochlorite	brocl
844	SeCl₂	Selenium Dichloride	secl2
845	SBr₂	Sulfur dibromide	sbr2
846	SeBr₂	Selenium dibromide	sebr2
847	BrOBr	Bromine oxide	brobr
848	F₃^-	trifluoride anion	f3-
849	Cl₃^-	trichloride anion	cl3-
850	Br₃^-	tribromide anion	br3-
851	I₃^-	triiodide	i3-
852	SFCl	Sulfur chloride fluoride	sfcl
853	HCCF	Fluoroacetylene	hccf
854	HCCF⁺	fluoroacetylene cation	hccf+
855	HCCCl	Chloroacetylene	hcccl
856	HCCBr	bromoacetylene	hccbr
857	HFCO	formyl fluoride	hfco
858	COHCl	Formyl chloride	cohcl
859	COHBr	Formyl bromide	cohbr
860	BHF₂	Difluoroborane	bhf2
861	BHCl₂	Borane, dichloro-	bhcl2
862	CHCl₂	dichloromethyl radical	chcl2
863	CHF₂	difluoromethyl radical	chf2
864	CHF₂⁺	difluoromethyl cation	chf2+
865	CHFCl	Chlorofluoromethyl radical	chfcl
866	CHFCl⁺	Chlorofluoromethyl cation	chfcl+
867	CHCl₂⁺	dichloromethyl cation	chcl2+
868	CHBr₂	dibromomethyl radical	chbr2
869	HOClO	Chlorous acid	hoclo
870	NHF₂	difluoramine	nhf2
871	NHCl₂	dichloroamine	nhcl2
872	CH₂F₂	Methane, difluoro-	ch2f2
873	CH₂FCl	fluorochloromethane	ch2fcl
874	SiH₂F₂	difluorosilane	sih2f2
875	CH₂Cl₂	Methylene chloride	ch2cl2
876	CH₂BrF	Methane, bromofluoro-	ch2fbr
877	CH₂BrCl	Methane, bromochloro-	ch2clbr
878	CH₂FI	fluoroiodomethane	ch2fi
879	CH₂Br₂	dibromomethane	ch2br2
880	CH₂ClI	chloroiodomethane	ch2cli
881	CH₂BrI	bromoiodomethane	ch2bri
882	CH₂I₂	Diiodomethane	ch2i2
883	SiH₂Cl₂	dichlorosilane	sih2cl2
884	CH₃MgBr	Methyl Magnesium Bromide	ch3mgbr
885	CH₂CHF	Ethene, fluoro-	ch2chf
886	CH₂CHF⁺	fluoroethene cation	ch2chf+
887	C₂H₃Cl	Ethene, chloro-	ch2chcl
888	C₂H₃Br	vinyl bromide	c2h3br
889	C₂H₃I	Vinyl iodide	c2h3i
890	CH₂FOH	fluoromethanol	ch2foh
891	CH₃OCl	methyl hypochlorite	ch3ocl
892	CH₂CH₂Cl	2-chloroethyl radical	ch2ch2cl
893	CHClCH₃	1-chloroethyl radical	chclch3
894	C₂H₅F	fluoroethane	c2h5f
895	CH₃CH₂Cl	Ethyl chloride	c2h5cl
896	CH₃SiFH₂	fluoromethylsilane	ch3sifh2
897	C₂H₅Br	Ethyl bromide	etbr
898	C₂H₅I	Ethyl iodide	c2h5i
899	KrF₂	Krypton difluoride	krf2
900	XeF₂	Xenon difluoride	xef2
901	B₄H₁₀	Tetraborane(10)	b4h10
902	C₄	Carbon tetramer	c4
903	C₄⁺	Carbon tetramer cation	c4+
904	C₄H₂	Diacetylene	c4h2
905	C₄H₂⁺	diacetlyene cation	c4h2+
906	C₂H₃CCH	1-Buten-3-yne	c2h3cch
907	C₄H₄	cyclobutadiene	cbd
908	H₂CCCCH₂	Butatriene	h2cccch2
909	C₄H₆	1-Methylcyclopropene	c3100047
910	C₄H₆	Cyclobutene	c822355
911	C₄H₆	Methylenecyclopropane	c6142730
912	CH₂CCHCH₃	1,2-Butadiene	butad12
913	CH₂CHCHCH₂	1,3-Butadiene	c106990
914	CH₃CCCH₃	2-Butyne	c503173
915	CHCCH₂CH₃	1-Butyne	c107006
916	CH₃CHCHCH₂	methylallyl radical	c4h7
917	C₄H₈	methylcyclopropane	mcp
918	CH₂C(CH₃)CH₃	1-Propene, 2-methyl-	isobute
919	CH₂CHCH₂CH₃	1-Butene	bute1
920	CH₃CHCHCH₃	2-Butene, (E)-	bute2e
921	CH₃CHCHCH₃	2-Butene, (Z)-	bute2z
922	B(CH₃)₃	trimethylborane	bme3
923	Al(CH₃)₃	trimethyl aluminum	tma
924	C(CH₃)₃	Tert-butyl radical	tbutyl
925	CH₂CH(CH₃)₂	Isobutyl radical	isobutyl
926	CH₃CHCH₂CH₃	2-Butyl radical	butyl2
927	CH₃CH(CH₃)CH₃	Isobutane	isobutane
928	CH₃CH₂CH₂CH₃	Butane	butane
929	SiH(CH₃)₃	trimethylsilane	trimsi
930	C₂N₂⁺	Cyanogen cation	c2n2+
931	P₄	Phosphorus tetramer	p4
932	As₄	Arsenic tetramer	as4
933	HCCCN	Cyanoacetylene	hcccn
934	HCCCN⁺	Cyanoacetylene cation	hcccn+
935	H₂CNCN	cyanamide, methylene	ch2ncn
936	HNCCNH	Ethenediimine	hnccnh
937	C₃H₃N	acrylonitrile	ch2chcn
938	C₃H₃N⁺	acrylonitrile cation	ch2chcn+
939	CH₃N₃	methyl azide	ch3n3
940	NH₂CCNH₂	Diaminoacetylene	daa
941	NH₂CH₂CN	Aminoacetonitrile	aan
942	CH₃NHN₂⁺	methyl azide, protonated	ch3nhn2+
943	C₂H₅CN	ethyl cyanide	c2h5cn
944	CH₅N₃	Guanidine	guanidine
945	C₄H₆	Bicyclo[1.1.0]butane	c157335
946	CH₃NNCH₃	(Z)-1,2-Dimethyldiazene	dmdiazz
947	H₂NCHCHNH₂	diaminoethylene	dae
948	CH₆N₃⁺	guanidinium	ch6n3+
949	C₃H₇N	Cyclopropylamine	cpram
950	CH₇N₃	triaminomethane	tam
951	C₃H₇N	Azetidine	azet
952	C₂H₈N₂	Ethylenediamine	ethdiam
953	CH₃NHNHCH₃	dimethyl hydrazine	dmh
954	CH₃CH(NH₂)CH₃	2-Propanamine	pram2
955	N(CH₃)₃	Trimethylamine	trimeam
956	NH₂CH₂CH₂CH₃	1-Propanamine	pram1
957	P(CH₃)₃	trimethylphosphine	tmp
958	N(SiH₃)₃	trisilylamine	tsa
959	As(CH₃)₃	trimethyl arsine	tmas
960	(CH₃)₃NH⁺	protonated trimethyl amine	ptma
961	C₃H₇NH₃⁺	n-propylamine, protonated	c3h7nh2
962	Li₂O₂	dilithium dioxide	li2o2
963	Na₂O₂	disodium dioxide	na2o2
964	K₂O₂	dipotassium dioxide	k2o2
965	B₂O₂	Diboron dioxide	b2o2
966	S₂N₂	Disulfur dinitride	s2n2
967	CO₃	Carbon trioxide	co3
968	CO₃^--	carbonate	co3--
969	CS₃^--	Carbonotrithioate	cs3--
970	NO₃	Nitrogen trioxide	no3
971	NO₃^-	nitrate anion	no3-
972	NO₃⁺	nitrogen trioxide cation	no3+
973	SO₃	Sulfur trioxide	so3
974	SO₃^-	Sulfur trioxide anion	so3-
975	SO₃^--	Sulfate dianion	so3--
976	SO₃⁺	Sulfur trioxide cation	so3+
977	SeO₃	selenium trioxide	seo3
978	S₄	Sulfur tetramer	s4
979	TeO₃	Tellurium trioxide	teo3
980	HCO₃^-	bicarbonate anion	hco3-
981	HNO₃	Nitric acid	hno3
982	HSO₃	Hydroxysulfonyl radical	hso3
983	NH₂NO₂	nitramide	nh2no2
984	C₂H₂CO	cyclopropenone	c2h2co
985	C₃H₂O	Propadienal	c3h2o
986	HCCCHO	2-propynal	hcccho
987	C₂H₂O₂	Ethanedial	c2h2o2
988	C₂H₂O₂⁺	Ethanedial cation	c2h2o2+
989	H₂CO₃	Carbonic acid	h2co3
990	H₂CS₃	thiocarbonic acid	h2cs3
991	H₂NO₃⁺	Nitric Acid, Protonated	h2no3+
992	H₂SO₃	Sulfurous acid	h2so3
993	C₂H₃NO	Nitrosoethylene	c2h3no
994	CH₃NCO	methylisocyante	ch3nco
995	HOCH₂CN	cyanomethanol	hoch2cn
996	CH₃COO^-	acetate anion	ch3coo-
997	CH₃NO₂	Methane, nitro-	ch3no2
998	CH₃ONO	Methyl nitrite	ch3ono
999	H₃BO₃	Boric acid	h3bo3
1000	H₃AlO₃	Aluminum hydroxide	h3alo3
1001	H₃CO₃⁺	carbonic acid, protonated	h3co3+
1002	C₃H₄O	2-Propyn-1-ol	c107197
1003	C₃H₄O	allenol	c9000071
1004	C₃H₄O	Cyclopropanone	cpone
1005	C₃H₄O	Methylketene	c6004440
1006	CH₂CHCHO	Acrolein	c3h4o
1007	NH₂CONH₂⁺	Urea cation	urea+
1008	NH₂CSNH₂	Thiourea	thiourea
1009	C₂H₄O₂	1,3-dioxetane	c2h4o2
1010	CH₃COOH	Acetic acid	ch3cooh
1011	CH₃OCHO	methyl formate	ch3ocho
1012	CHOCH₂OH	hydroxy acetaldehyde	haa
1013	NH₂COOH₂⁺	Carbamic acid, O-protonated	nh2cooh2+
1014	NH₃COOH⁺	protonated Carbamic acid	nh3cooh+
1015	H₂OHCOOH	Water formic acid dimer 1	h2ohcooh_10
1016	H₂OHCOOH	Water formic acid dimer 2	h2ohcooh_11
1017	HCOOHH₂O	Formic acid water dimer	hcoohh2o
1018	HOCH₂OOH	hydroxy methyl peroxide	hoch2ooh
1019	CH₃COCH₂	Acetonyl radical	ch3coch2
1020	CH₂C(OH)NH₂	1-amino vinyl alchohol	ava
1021	CH₃C(OH)=NH	Ethaninidic acid	eia
1022	CH₃CHNOH	Acetaldoxime	acetaldoxime
1023	CH₃CONH₂	Acetamide	acetamide
1024	HCONHCH₃	N-methylformamide	nmfa
1025	CH₃CSNH₂	Ethanethioamide	ch3csnh2
1026	CH₅N₂O⁺	urea, N-protonated	ch4n2o+
1027	H₂NCOHNH₂⁺	urea, protonated	ureah+
1028	C₂H₅OO	ethylperoxy radical	c2h5oo
1029	CH₃NNCH₃	(E)-1,2-Dimethyldiazene	dmdiaze
1030	C₃H₅OH	Cyclopropanol	cproh
1031	C₃H₆O	2-Propen-1-ol	c107186
1032	C₃H₆O	Acetone enol	enol
1033	C₃H₆O	Propylene oxide	prox
1034	CH₃CH₂CHO	Propanal	propanal
1035	CH₃COCH₃	Acetone	acetone
1036	CH₃COCH₃^-	acetone anion	ch3coch3-
1037	C₃H₆S	Thietane	thietane
1038	C₃H₆S	Thiirane, methyl-	methiirane
1039	CH₃CSCH₃	Thioacetone	ch3csch3
1040	C₂H₆O₂	1,2-Ethanediol	ethdiol
1041	CH₃OOCH₃	dimethylperoxide	dmp
1042	CH₃SOCH₃	Dimethyl sulfoxide	dmso
1043	CH₂SHCH₂SH	1,2-Ethanedithiol	ethdisl
1044	CH₃SSCH₃	Disulfide, dimethyl	ch3ssch3
1045	CH₃COHCH₃⁺	acetone, protonated	acetoneh+
1046	HOCH₂CH₂NH₂	monoethanolamine	mea
1047	C₃H₇OH	1-Propanol	proh
1048	CH₃CHOHCH₃	Isopropyl alcohol	isoproh
1049	CH₃OC₂H₅	Ethane, methoxy-	etome
1050	C₃H₇SH	1-Propanethiol	prsh
1051	CH₃CHSHCH₃	2-Propanethiol	isoprsh
1052	CH₃SCH₂CH₃	Ethane, (methylthio)-	etsme
1053	H₂OCH₃OCH₃	water dimethylether dimer	h2och3och3
1054	Li₂F₂	Lithium fluoride dimer	li2f2
1055	Na₂F₂	Sodium Fluoride Dimer	na2f2
1056	Na₂Cl₂	Disodium dichloride	na2cl2
1057	C₂F₂	difluoroacetylene	c2f2
1058	C₂Cl₂	dichloroacetylene	c2cl2
1059	C₂Cl₂⁺	dichloroacetylene cation	c2cl2+
1060	FNO₂	Nitryl fluoride	fno2
1061	FONO	Nitrosyl hypofluorite	fono
1062	ClNO₂	Nitryl chloride	clno2
1063	ClONO	chlorine nitrite	clono
1064	BrONO	Bromine nitrite	brono
1065	N₂F₂	(Z)-Difluorodiazene	n2f2_z
1066	N₂F₂	Dinitrogen difluoride, (E)-	n2f2_e
1067	CF₂O	Carbonic difluoride	f2co
1068	CF₂O⁺	Carbonic difluoride cation	f2co+
1069	COFCl	Carbonic chloride fluoride	cofcl
1070	CCl₂O	Phosgene	cl2co
1071	Cl₂CS	Thiophosgene	cl2cs
1072	COBr₂	Carbonic dibromide	cobr2
1073	BF₃^-	Borane, trifluoro- anion	bf3-
1074	BF₃⁺	boron trifluoride cation	bf3+
1075	AlF₃	Aluminum trifluoride	alf3
1076	BClF₂	Chlorodifluoroborane	bclf2
1077	AlF₂Cl	Aluminum chloride difluoride	alclf2
1078	ScF₃	Scandium trifluoride	ScF3
1079	AlFCl₂	Aluminum dichloride fluoride	alcl2f
1080	BCl₃	Borane, trichloro-	bcl3
1081	BCl₃⁺	Boron Trichloride cation	bcl3+
1082	GaF₃	Gallium trifluoride	gaf3
1083	AlCl₃	Aluminum trichloride	alcl3
1084	GaCl₃	Gallium trichloride	gacl3
1085	BBr₃	Boron tribromide	bbr3
1086	AlBr₃	Aluminum Bromide	albr3
1087	ClO₃	Chlorine trioxide	clo3
1088	ClO₃^-	chlorate anion	clo3-
1089	BrO₃^-	Bromate anion	bro3-
1090	CF₃	Trifluoromethyl radical	cf3
1091	CF₃^-	Trifluoromethyl anion	cf3-
1092	CF₃⁺	Trifluoromethyl cation	cf3+
1093	CF₂Cl	difluorochloromethyl radical	cf2cl
1094	SiF₃	Silicon trifluoride radical	sif3
1095	SiF₃⁺	Silicon trifluoride cation	sif3+
1096	CFCl₂	dichlorofluoromethyl radical	cfcl2
1097	CCl₃	Trichloromethyl radical	ccl3
1098	CCl₃^-	Trichloromethyl anion	ccl3-
1099	CCl₃⁺	Trichloromethyl cation	ccl3+
1100	SiCl₃	trichlorosilyl radical	sicl3
1101	SiCl₃⁺	trichlorosilyl cation	sicl3+
1102	CBr₃	tribromomethyl radical	cbr3
1103	FOOF	Perfluoroperoxide	foof
1104	ClO₂F	Chloryl fluoride	clo2f
1105	F₂SO	Thionyl Fluoride	f2so
1106	ClOOCl	Dichlorine dioxide	cloocl
1107	FSSF	Difluorodisulfane	fssf
1108	S₂F₂	Thio-thionyl fluoride	s2f2
1109	SOCl₂	thionyl chloride	socl2
1110	SSCl₂	Thiothionyl chloride	sscl2
1111	SeOCl₂	selenium oxychloride	seocl2
1112	NF₃	Nitrogen trifluoride	nf3
1113	NF₃^-	Nitrogen trifluoride anion	nf3-
1114	NF₃⁺	Nitrogen trifluoride cation	nf3+
1115	PF₃	Phosphorus trifluoride	pf3
1116	NCl₃	nitrogen trichloride	ncl3
1117	AsF₃	Arsenic trifluoride	asf3
1118	PCl₃	Phosphorus trichloride	pcl3
1119	SbF₃	Antimony Trifluoride	sbf3
1120	AsCl₃	Arsenous trichloride	ascl3
1121	SbCl₃	Antimony Trichloride	sbcl3
1122	PBr₃	Phosphorus tribromide	pbr3
1123	AsBr₃	Arsenic tribromide	asbr3
1124	NI₃	Nitrogen triiodide	ni3
1125	PI₃	Phosphorus triiodide	pi3
1126	ClSSCl	Disulfur dichloride	s2cl2
1127	SF₃	Sulfur trifluoride	sf3
1128	ClF₃	Chlorine trifluoride	clf3
1129	BrF₃	Bromine trifluoride	brf3
1130	IF₃	iodone trifluoride	if3
1131	HClO₃	Chloric Acid	hclo3
1132	CHF₃	Methane, trifluoro-	chf3
1133	CHF₂Cl	difluorochloromethane	chf2cl
1134	SiHF₃	trifluorosilane	sihf3
1135	CHFCl₂	fluorodichloromethane	chfcl2
1136	CDCl₃	trichloromethane-d	cdcl3
1137	CHCl₃	Chloroform	chcl3
1138	CHBrF₂	Methane, bromodifluoro-	chbrf2
1139	SiHCl₃	Trichlorosilane	sihcl3
1140	CHFClBr	fluorochlorobromomethane	chfclbr
1141	CHBrCl₂	Methane, bromodichloro-	chbrcl2
1142	CHF₂I	difluoroiodomethane	chf2i
1143	CHBr₂F	dibromofluoromethane	chbr2f
1144	CHFClI	fluorochloroiodomethane	chfcli
1145	CHCl₂I	dichloroiodomethane	chcl2i
1146	CHClBr₂	Methane, dibromochloro-	chclbr2
1147	CHBr₃	bromoform	chbr3
1148	CHI₃	Iodoform	chi3
1149	NF₃H⁺	protonated nitrogen trifluoride	nf3h+
1150	AsF₃H⁺	Arsenic trifluoride, protonated	asf3h+
1151	C₂H₂F₂	Ethene, 1,2-difluoro-, (E)-	c2h2f2e
1152	C₂H₂F₂	Ethene, 1,2-difluoro-, (Z)-	c2h2f2z
1153	CH₂CF₂	Ethene, 1,1-difluoro-	ch2cf2
1154	C₂H₂ClF	1-chloro-1-fluoroethylene	c2h2clf
1155	CHFCHCl	(E)-1-chloro-2-fluoroethene	chfchcle
1156	CHFCHClz	(Z)-1-Chloro-2-fluoroethene	chfchclz
1157	CH₂CCl₂	Ethene, 1,1-dichloro-	ch2ccl2
1158	CHClCHCl	Ethene, 1,2-dichloro-, (E)-	chclchcle
1159	CHClCHCl	Ethene, 1,2-dichloro-, (Z)-	chclchclz
1160	C₂H₂Br₂	1,1-dibromoethene	c2h2br2
1161	CHBrCHBr	Ethene, 1,2-dibromo-, (E)-	chbrchbre
1162	CHBrCHBr	Ethene, 1,2-dibromo-, (Z)-	chbrchbrz
1163	CH₂FCHO	Fluoroacetaldehyde	ch2fcho
1164	CH₃COF	Acetyl fluoride	ch3cof
1165	CH₂ClCHO	chloroacetaldehyde	ch2clcho
1166	CH₃COCl	Acetyl Chloride	ch3cocl
1167	C₂H₄F₂	1,2-difluoroethane	c2h4f2
1168	CH₃CHF₂	Ethane, 1,1-difluoro-	ch3chf2
1169	CH₂FCH₂Cl	Ethane, 1-chloro-2-fluoro-	ch2fch2cl
1170	CH₃CHFCl	Ethane, 1-chloro-1-fluoro-	ch3chfcl
1171	CH₂ClCH₂Cl	Ethane, 1,2-dichloro-	ch2clch2cl
1172	CH₃CHCl₂	Ethane, 1,1-dichloro-	ch3chcl2
1173	CH₂BrCH₂Cl	1-bromo-2-chloroethane	ch2brch2cl
1174	CH₂BrCH₂Br	Ethane, 1,2-dibromo-	ch2brch2br
1175	CH₂CFCH₃	2-fluoropropene	2fpro
1176	CH₂CHCH₂F	Allyl Fluoride	allylf
1177	CH₃CHCHF	trans-1-Fluoro-1-propene	propene1ft
1178	C₃H₅Cl	1-Propene, 3-chloro-	prop1cl3
1179	C₃H₅Cl	1-chloro-1-propene(E)	prop1cl1e
1180	C₃H₅Cl	1-chloro-1-propene(Z)	prop1cl1z
1181	CH₂FCH₂OH	2-fluoroethanol	ch2fch2oh
1182	CH₂ClCH₂OH	2-Chloroethanol	ch2clch2oh
1183	CH₂ClCH₂OH₂⁺	2-chloroethanol, protonated	ch2clch2oh2+
1184	CH₂FCH₂CH₃	1-Fluoropropane	prf1
1185	CH₃CHFCH₃	2-Fluoropropane	prf2
1186	CH₂ClCH₂CH₃	Propane, 1-chloro-	prcl1
1187	CH₃CHClCH₃	Propane, 2-chloro-	prcl2
1188	CH₃CH₂CH₂Br	n-propyl bromide	prbr
1189	CH₃CHBrCH₃	i-propyl bromide	iprbr
1190	C₃H₉O⁺	trimethyl oxonium cation	c3h9o+
1191	B₅H₉	pentaborane9	b5h9
1192	C₅H₄	pentatetraene	ptrene
1193	C₅H₅	cyclopentadienyl radical	c5h5
1194	C₅H₅^-	cylopentadienyl anion	c5h5-
1195	C₅H₆	1,3-Cyclopentadiene	c542927
1196	C₅H₆	1-Buten-3-yne, 2-methyl-	c78808
1197	C₅H₆	3-Penten-1-yne, (E)-	c2004695
1198	C₅H₆	3-Penten-1-yne, (Z)-	c1574409
1199	C₅H₆	Bicyclo[2.1.0]pent-2-ene	c5164352
1200	C₅H₆	Cyclopropylacetylene	c6746947
1201	C₅H₆	Propellane	propellane
1202	C₅H₇	1,3-pentadienyl radical	pdyl
1203	C₅H₇	cyclopentenyl radical	cpyl
1204	C₅H₈	1,2-Butadiene, 3-methyl-	c598254
1205	C₅H₈	1,2-Pentadiene	c591957
1206	C₅H₈	1,3-Butadiene, 2-methyl-	c78795
1207	C₅H₈	1,3-Pentadiene, (E)-	c2004708
1208	C₅H₈	1,3-Pentadiene, (Z)-	c1574410
1209	C₅H₈	1,4-Pentadiene	c591935
1210	C₅H₈	1-pentyne	a1pentyne
1211	C₅H₈	2,3-Pentadiene	c591968
1212	C₅H₈	Bicyclo[1.1.1]pentane	bcp
1213	C₅H₈	Cyclobutane, methylene-	c1120565
1214	C₅H₈	Cyclopentene	c142290
1215	C₅H₈	Ethenylcyclopropane	c693867
1216	CH₃CCCH₂CH₃	2-Pentyne	2pentyne
1217	C₅H₁₀	1-Butene, 2-methyl-	c563462
1218	C₅H₁₀	2-Butene, 2-methyl-	c513359
1219	C₅H₁₀	2-Pentene, (E)-	c646048
1220	C₅H₁₀	2-Pentene, (Z)-	c627203
1221	C₅H₁₀	Cyclopentane	c287923
1222	C₅H₁₀	Cyclopropane, 1,1-dimethyl-	c1630940
1223	CH₂CHCH₂CH₂CH₃	1-pentene	pentene
1224	C₅H₁₁	2-Methylbut-2-yl radical	c4348350
1225	C₅H₁₂	Butane, 2-methyl-	buta2
1226	C₅H₁₂	Pentane	pentane
1227	C₅H₁₂	Propane, 2,2-dimethyl-	neopentane
1228	Si(CH₃)₄	tetramethylsilane	tms
1229	N₂O₃	Dinitrogen trioxide	n2o3
1230	C₃H₂N₂	Malononitrile	c3h2n2
1231	CH₂N₄	1H-Tetrazole	1htz
1232	C₃H₃N₂	imidazolyl radical	im
1233	C₃H₃N₂^-	imidizolyl anion	im-
1234	C₂H₃N₃	1H-1,2,4-Triazole	c288880
1235	C₄H₄N	pyrrolide radical	c4h4n
1236	C₄H₄N^-	pyrrolide anion	c4h4n-
1237	C₃H₄N₂	1H-Imidazole	1himidaz
1238	C₃H₄N₂	1H-Pyrazole	1hpyraz
1239	C₃H₄N₂	2H-Imidazole	imid2h
1240	C₃H₄N₂	4H-Imidazole	imid4h
1241	C₄H₅N	(E)-2-Butenenitrile	c627269
1242	C₄H₅N	(Z)-2-Butenenitrile	c1190767
1243	C₄H₅N	2H-pyrrole	pyrrole2
1244	C₄H₅N	3H-pyrrole	pyrrole3
1245	C₄H₅N	Cyclopropanecarbonitrile	c5500210
1246	C₄H₅N	Pyrrole	pyrrole
1247	CH₂CHCH₂CN	Allylcyanide	ch2chch2cn
1248	C₄H₆N⁺	pyrrole, alpha-protonated	appyr
1249	C₄H₆N⁺	pyrrole, beta-protonated	bppyr
1250	C₄H₆N⁺	pyrrole, protonated	ppyr
1251	C₃H₆N₂	3-Aminopropionitrile	c151188
1252	CH₃CH(CH₃)CN	Propanenitrile, 2-methyl-	c4h7n
1253	CH₃CH₂CH₂CN	Butanenitrile	c109740
1254	C₅H₈	Bicyclo[2.1.0]pentane	c185944
1255	C₅H₈	Spiropentane	c157404
1256	C₄H₉N	Cyclobutylamine	cbam
1257	C₄H₉N	Pyrrolidine	pyrrolidine
1258	C₃H₁₀N₂	1,2-Diaminopropane	diampr12
1259	C(CH₃)₃NH₂	2-Propanamine, 2-methyl-	c75649
1260	C(NH₂)H₂C(CH₃)HCH₃	1-Propanamine, 2-methyl-	c78819
1261	C(NH₂)H₂CH₂CH₂CH₃	1-Butanamine	butam1
1262	CH₃C(NH₂)HCH₂CH₃	2-Butanamine	butam2
1263	NH(C₂H₅)₂	diethylamine	dea
1264	NC₄H₁₂⁺	tetramethyl ammonium cation	nc4h12+
1265	C₃O₂	Carbon suboxide	c3o2
1266	C₃O₂⁺	Carbon suboxide cation	c3o2+
1267	B₂O₃	diboron trioxide	b2o3
1268	MgCO₃	Magnesium Carbonate	mgco3
1269	BeCO₃	Beryllium Carbonate	beco3
1270	CaCO₃	Calcium Carbonate	caco3
1271	ONONO	Nitrosyl nitrite	onono
1272	PO₄^---	phosphate	po4---
1273	SO₄^--	sulfate	so4--
1274	HOONO₂	peroxy nitric acid	hoono2
1275	HSO₄^-	bisulfate anion	hso4-
1276	C₂H₂N₂S	1,3,4-Thiadiazole	c2h2n2s
1277	C₃H₂O₂	Propiolic acid	c3h2o2
1278	CHOCOOH	oxo acetic acid	oaa
1279	CHOOCHO	diformyl ether	choocho
1280	H₂SO₄	Sulfuric acid	h2so4
1281	H₂SeO₄	Selenic acid	h2seo4
1282	C₃H₃NO	Isoxazole	isox
1283	C₃H₃NO	Oxazole	oxazole
1284	C₃H₃NS	Thiazole	thiazole
1285	CH₃C(O)OO	acetyl peroxy radical	ch3coo2
1286	CH₃NO₃	Methyl nitrate	ch3no3
1287	H₃PO₄	Phosphoric Acid	h3po4
1288	C₄H₄O	Furan	furan
1289	C₄H₄O⁺	Furan cation	furan+
1290	CH₃COCCH	3-butyn-2-one	c1423605
1291	C₄H₄S	Thiophene	furans
1292	C₄H₄Se	selenophene	c4h4se
1293	C₃H₄O₂	β–Propiolactone	beta
1294	C₃H₄O₂	2-Propenoic acid	propenoic2
1295	C₃H₄O₂	Methyl glyoxal	megly
1296	C₃H₄O₂	propanedial	propanedial
1297	C₃H₄O₂	propenalol	propenalol
1298	HOCHCCHOH	allenediol	aldiol
1299	C₂H₄O₃	1,2,3-trioxolane	c2h4o3
1300	C₂H₄O₃	trioxolane124	triox
1301	HOCH₂COOH	Hydroxyacetic acid	hac
1302	CH₂CHCONH₂	Acrylamide	c79061
1303	CH₃OCH₂CN	Methoxyacetonitrile	c1738369
1304	CH₅N₃S	Hydrazinecarbothioamide	c79196
1305	H₂NCH₂COOH	Glycine	glycine
1306	CH₃SO₂NH₂	methanesulfonamide	ch3so2nh2
1307	C₄H₆O	cis-2-butenal	butenal2c
1308	C₄H₆O	Cyclobutanone	cbutone
1309	C₄H₆O	Furan, 2,3-dihydro-	furan23h
1310	C₄H₆O	Furan, 2,5-dihydro-	furan25h
1311	CH₂CHOCHCH₂	Vinyl ether	vinylether
1312	CHOCHCHCH₃	2-Butenal	butenal2
1313	C₄H₆S	Thiophene, 2,3-dihydro-	thiop23h
1314	C₄H₆S	Thiophene, 2,5-dihydro-	thiop25h
1315	CH₂CHSCHCH₂	Divinyl sulfide	divis
1316	C₂H₆N₂O	Urea, methyl-	c598505
1317	C₃H₆O₂	1,3-Dioxolane	dioxolane
1318	CH₃CH₂COOH	Propanoic Acid	propanoic
1319	CH₃COOCH₃	methyl acetate	aame
1320	HCOOC₂H₅	Ethyl formate	faee
1321	C₂H₆O₂S	Dimethyl sulfone	c67710
1322	CH₃SSSCH₃	dimethyl trisulfide	c2h6s3
1323	C₃H₇NO	dimethylformamide	dmf
1324	C₃H₇NO	Propanamide	propanam
1325	C₂H₃OC₂H₅	Ethene, ethoxy-	c109922
1326	C₄H₈O	Cyclobutanol	c2919235
1327	C₄H₈O	Furan, tetrahydro-	thf
1328	CH₂C(CH₃)OCH₃	1-Propene, 2-methoxy-	pre1meo2
1329	CH₃COCH₂CH₃	2-Butanone	buta2one
1330	CHOCH(CH₃)CH₃	Propanal, 2-methyl-	c78842
1331	CHOCH₂CH₂CH₃	Butanal	butanal
1332	C₄H₈S	Thiophene, tetrahydro-	tht
1333	C₃H₈O₂	1,3-Propanediol	c504632
1334	C₃H₈O₂	Hydroperoxide, 1-methylethyl	c3031752
1335	C₃H₈O₂	Methane, dimethoxy-	c109875
1336	C₃H₈O₂	Propylene glycol	c57556
1337	C₃H₈S₂	1,3-Propanedithiol	c109808
1338	C₄H₁₀O	1-Butanol	butanol1
1339	C₄H₁₀O	1-Propanol, 2-methyl-	c78831
1340	C₄H₁₀O	2-Butanol, (.+/-.)-	butanol2
1341	C₄H₁₀O	Ethanol, 1,1-dimethyl-	tbuoh
1342	C₄H₁₀O	Ethoxy ethane	etoet
1343	C₄H₁₀O	Methyl propyl ether	meopr
1344	C₄H₁₀O	Propane, 2-methoxy-	c598538
1345	C₄H₁₀O⁺	1-Butanol cation	butanol1+
1346	C(CH₃)₃SH	2-Propanethiol, 2-methyl-	tbush
1347	C₂H₅SC₂H₅	Diethyl sulfide	etset
1348	C₄H₉SH	1-Butanethiol	bush
1349	CH₂(SH)CH(CH₃)CH₃	1-Propanethiol, 2-methyl-	c513440
1350	CH₃C(SCH₃)HCH₃	Propane, 2-(methylthio)-	mesipr
1351	CH₃CH(SH)CH₂CH₃	2-Butanethiol	butansl2
1352	FNO₃	Fluorine nitrate	fno3
1353	ClONO₂	Chlorine nitrate	clono2
1354	TiCl₄	Titanium tetrachloride	ticl4
1355	ClO₄^-	perchlorate anion	clo4-
1356	BF₄^-	tetrafluoroboron anion	bf4-
1357	ClFO₃	Perchloryl fluoride	clfo3
1358	SO₂F₂	Sulfuryl fluoride	so2f2
1359	SO₂Cl₂	Sulfuryl chloride	so2cl2
1360	F₃NO	Nitrogen trifluoride oxide	f3no
1361	F₃PO	Phosphoryl fluoride	pf3o
1362	Cl₃PO	Phosphoryl chloride	pcl3o
1363	CF₄	Carbon tetrafluoride	cf4
1364	CF₃Cl	Methane, chlorotrifluoro-	cf3cl
1365	SiF₄	Silicon tetrafluoride	sif4
1366	CF₂Cl₂	difluorodichloromethane	cf2cl2
1367	TiF₄	Titanium tetrafluoride	tif4
1368	CFCl₃	Trichloromonofluoromethane	cfcl3
1369	CF₃Br	Bromotrifluoromethane	cf3br
1370	GeF₄	Germanium tetrafluoride	gef4
1371	CCl₄	Carbon tetrachloride	ccl4
1372	CCl₄⁺	Carbon tetrachloride cation	ccl4+
1373	CBrClF₂	Methane, bromochlorodifluoro-	cbrclf2
1374	SiCl₄	Silane, tetrachloro-	sicl4
1375	CBrCl₂F	bromodichlorofluoromethane	cbrcl2f
1376	CF₃I	trifluoroiodomethane	cf3i
1377	CBrCl₃	Methane, bromotrichloro-	cbrcl3
1378	CBr₂F₂	Methane, dibromodifluoro-	cbr2f2
1379	GeCl₄	Germanium Tetrachloride	gecl4
1380	CBr₂ClF	dibromochlorofluoromethane	cbr2clf
1381	CBr₂Cl₂	dibromodichloromethane	cbr2cl2
1382	CCl₃I	trichloroiodomethane	ccl3i
1383	CFBr₃	fluorotribromomethane	cfbr3
1384	CFClBrI	fluorochlorobromoiodomethane	cfclbri
1385	CBr₃Cl	tribromochloromethane	cbr3cl
1386	CF₂I₂	difluorodiiodomethane	cf2i2
1387	CBr₄	Carbon tetrabromide	cbr4
1388	CCl₂I₂	dichlorodiiodomethane	ccl2i2
1389	SiBr₄	Silicon tetrabromide	sibr4
1390	CBr₃I	tribromoiododmethane	cbr3i
1391	GeBr₄	Germanium tetrabromide	gebr4
1392	CI₄	tetraiodomethane	ci4
1393	SiI₄	silicon tetraiodide	sii4
1394	ClOF₃	Chlorine trifluoride oxide	clof3
1395	SF₄	Sulfur tetrafluoride	sf4
1396	SeF₄	Selenium tetrafluoride	sef4
1397	SCl₄	Sulfur tetrachloride	scl4
1398	C₂HF₃	Trifluoroethylene	c2hf3
1399	C₂HF₃⁺	Trifluoroethylene cation	c2hf3+
1400	CHClCCl₂	Trichloroethylene	chclccl2
1401	CHBrCF₂	1-Bromo-2,2-difluoroethylene	chbrcf2
1402	HClO₄	perchloric acid	hclo4
1403	HSO₃F	Fluorosulfonic acid	hso3f
1404	CF₃OH	trifluoromethanol	cf3oh
1405	CH₂ClCCCl	1,3-dichloropropyne	ch2clcccl
1406	CHClCCHCl	1,3-dichloroallene	chclcchcl
1407	CHCl₂CCH	3,3-dichloropropyne	chcl2cch
1408	CHCl₂CHO	dichloroacetaldehyde	chcl2cho
1409	PF₃CH₂	phosphorane, trifluoromethylene-	pf3ch2
1410	CH₃CF₃	Ethane, 1,1,1-trifluoro-	ch3cf3
1411	CHF₂CH₂F	Ethane, 1,1,2-trifluoro	ch2fchf2
1412	CH₃CF₂Cl	1-Chloro-1,1-Difluoroethane	ch3cf2cl
1413	CH₃CFCl₂	1,1-Dichloro-1-fluoroethane	ch3cfcl2
1414	CH₂ClCHCl₂	1,1,2-trichloroethane	ch2clchcl2
1415	CH₃CCl₃	Ethane, 1,1,1-trichloro-	ch3ccl3
1416	SiCl₃CH₃	methyltrichlorosilane	sicl3ch3
1417	CH₃CBr₃	1,1,1-tribromoethane	ch3cbr3
1418	NH₃BCl₃	Amminetrichloroboron	nh3bcl3
1419	SiH₃CCl₃	(trichloromethyl)silane	sih3ccl3
1420	CH₂CClCHCH₂	1,3-Butadiene, 2-chloro-	c4h5cl
1421	C₃H₅ClO	Oxirane, (chloromethyl)-	c106898
1422	CH₂FCH₂CH₂F	1,3-difluoropropane	ch2fch2ch2f
1423	CH₃CF₂CH₃	2,2-difluoropropane	ch3cf2ch3
1424	CH₂ClCH₂CH₂Cl	1,3-dichloropropane	prdicl13
1425	CH₂ClCHClCH₃	Propane, 1,2-dichloro-	prdicl12
1426	CH₃CCl₂CH₃	Propane, 2,2-dichloro-	prdicl22
1427	CHCl₂CH₂CH₃	1,1-dichloropropane	prdicl11
1428	SiCl₂(CH₃)₂	dichlorodimethylsilane	sicl2me2
1429	CH₂CClCH₂CH₃	1-Butene, 2-chloro-	bute1cl2
1430	CH₂CHCH₂CH₂Cl	1-Butene, 4-chloro-	bute1cl4
1431	CH₂CHCHClCH₃	1-Butene, 3-chloro-	bute1cl3
1432	CH₂ClCHCHCH₃	2-Butene, 1-chloro-	bute2cl1
1433	CH₃CClCHCH₃	2-Butene, 2-chloro-, (E)-	bute2cl2e
1434	CH₃CClCHCH₃	2-Butene, 2-chloro-, (Z)-	bute2cl2z
1435	CHClCHCH₂CH₃	(E)-1-Chloro-1-butene	bute1cl1
1436	CHClCHCH₂CH₃	(Z)-1-Chloro-1-butene	bute1cl1z
1437	C₄H₉F	1-fluorobutane	butaf1
1438	CH₃CHFCH₂CH₃	2-fluorobutane	butaf2
1439	CH₂ClCH₂CH₂CH₃	Butane, 1-chloro-	butacl1
1440	CH₃CCl(CH₃)CH₃	Propane, 2-chloro-2-methyl-	procl2me2
1441	CH₃CHClCH₂CH₃	Butane, 2-chloro-	butacl2
1442	XeF₄	Xenon tetrafluoride	xef4
1443	C₂H₂N₂O	Furazan	furazan
1444	CF₃PH₂	phosphine, (trifluoromethyl)-	cf3ph2
1445	NH₃BF₃	Amminetrifluoroboron	nh3bf3
1446	C₆H₂	hexatriyne	c6h2
1447	C₆H₄	(E)-Hexa-1,5-diyne-3-ene	c6h4e
1448	C₆H₄	(Z)-Hexa-1,5-diyne-3-ene	c6h4z
1449	C₆H₄	Benzyne	benzyne
1450	C₆H₅	phenyl	phenyl
1451	C₆H₅^-	phenyl anion	phenyl-
1452	C₆H₆	Prismane	prismane
1453	C₆H₆	1,2,4,5-Hexatetraene	ht1245
1454	C₆H₆	2,4-Hexadiyne	hexadiyne
1455	C₆H₆	3,4-Dimethylenecyclobutene	cb34m
1456	C₆H₆	Benzene	benzene
1457	C₆H₆	Benzvalene	bv
1458	C₆H₆	Dewar Benzene	dewar
1459	C₆H₆	Hexa-1,5-diene-3-yne	hdy153
1460	C₆H₆	Trimethylenecycopropane	tmcp
1461	C₆H₆⁺	Benzene cation	c6h6+
1462	C₆H₇⁺	benzene, protonated	c6h7+
1463	C₆H₈	(E)-hexa-1,3,5-triene	c821078
1464	C₆H₈	(E)-hexa-2,3,4-triene	c59660650
1465	C₆H₈	(Z)-hexa-1,3,5-triene	hexatri135
1466	C₆H₈	(Z)-hexa-2,3,4-triene	hetr234c
1467	C₆H₈	1,3-Cyclohexadiene	cyhexadiene13
1468	C₆H₈	1,4-Cyclohexadiene	cyhexadiene14
1469	C₆H₈	3-Methylenecyclopentene	c930267
1470	C₆H₈	Bicyclo[2.1.1]hex-2-ene	c822413
1471	C₆H₈	Bicyclo[2.2.0]hex-1(4)-ene	c30830207
1472	C₆H₈	Bicyclo[3.1.0]hex-2-ene	c694019
1473	C₆H₁₀	1,3-Hexadiene, (E)-	hexdi13e
1474	C₆H₁₀	1,3-Hexadiene, (Z)-	hexdi13z
1475	C₆H₁₀	1,4-Hexadiene, (E)-	hexdi14t
1476	C₆H₁₀	1,4-Hexadiene, (Z)-	hexdi14z
1477	C₆H₁₀	1,5-Hexadiene	c592427
1478	C₆H₁₀	1-Butyne, 3,3-dimethyl-	c917920
1479	C₆H₁₀	1-Hexyne	hexyne1
1480	C₆H₁₀	2,4-Hexadiene, (E,E)-	hexdi24ee
1481	C₆H₁₀	2,4-Hexadiene, (E,Z)-	hexdi24ez
1482	C₆H₁₀	2,4-Hexadiene, (Z,Z)-	hexdi24zz
1483	C₆H₁₀	2-Hexyne	c764352
1484	C₆H₁₀	3-Hexyne	hexyne3
1485	C₆H₁₀	cyclohexene	cyclohexene
1486	C₆H₁₀	Cyclopentene, 1-methyl-	c693890
1487	C₆H₁₀	Cyclopentene, 3-methyl-	c1120623
1488	C₆H₁₀	Cyclopentene, 4-methyl-	c1759815
1489	C₄H₆(CH₃)₂	1,1-dimethylcyclobutane	dmcb11
1490	C₆H₁₂	(1R,2R)-1,2-dimethylcyclobutane	dmcb12t
1491	C₆H₁₂	(1r,3r)-1,3-dimethylcyclobutane	dmcb13t
1492	C₆H₁₂	(E)-2-Hexene	e2hexene
1493	C₆H₁₂	(E)-3-methylpent-2-ene	c616126
1494	C₆H₁₂	(E)-hex-3-ene	e3hexene
1495	C₆H₁₂	(Z)-3-methylpent-2-ene	c922623
1496	C₆H₁₂	(Z)-hex-2-ene	z2hexene
1497	C₆H₁₂	(Z)-hex-3-ene	z3hexene
1498	C₆H₁₂	2,3-dimethylbut-1-ene	c563780
1499	C₆H₁₂	2,3-dimethyl-but-2-ene	tmeet
1500	C₆H₁₂	3-methylenepentane	c760214
1501	C₆H₁₂	cis-1,2-dimethylcyclobutane	dmcb12c
1502	C₆H₁₂	cis-1,3-dimethylcyclobutane	dmcb13c
1503	C₆H₁₂	Cyclohexane	cyclohexane
1504	C₆H₁₂	Cyclopentane, methyl-	c96377
1505	C₆H₁₂	Ethylcyclobutane	c4806615
1506	C₆H₁₂	hex-1-ene	hexene1
1507	C₆H₁₄	Butane, 2,2-dimethyl-	buta22
1508	C₆H₁₄	Butane, 2,3-dimethyl-	buta23
1509	C₆H₁₄	Hexane	hexane
1510	C₆H₁₄	Pentane, 2-methyl-	penta2
1511	C₆H₁₄	Pentane, 3-methyl-	penta3
1512	C₄N₂	2-Butynedinitrile	c4n2
1513	N₃P₃	1,3,5,2,4,6-Triazatriphosphorine	n3p3
1514	C₄H₂N₂	Fumaronitrile	c4h2n2
1515	C₂H₂N₄	sym-tetrazine	ttz
1516	C₃H₃N₃	1,3,5-Triazine	triazine135
1517	CH₃N₅	5-Aminotetrazole	c4418615
1518	C₄H₄N₂	1,3-Diazine	diazine13
1519	C₄H₄N₂	Pyrazine	pyrazine
1520	C₄H₄N₂	Pyridazine	pyridazine
1521	C₄H₄N₂	Succinonitrile	c110612
1522	C₂H₄N₄	1H-Tetrazole, 1-methyl-	c16681779
1523	C₂H₄N₄	1H-Tetrazole, 5-methyl-	c4076362
1524	C₂H₄N₄	2H-Tetrazole, 2-methyl-	c16681780
1525	C₅H₅N	Bicyclo[1.1.0]butane-1-carbonitrile	bibucn
1526	C₅H₅N	E-2,4-pentadienenitrile	bdcn
1527	C₅H₅N	Pyridine	pyridine
1528	B₃N₃H₆	borazine	borazine
1529	C₆H₆	Fulvene	fulvene
1530	C₅H₆N⁺	Pyridinium	c5h6n
1531	C₄H₆N₂	1H-Imidazole, 2-methyl-	c693981
1532	C₅H₇N	(E)-2-Pentenenitrile	c26294984
1533	C₅H₇N	(E)-3-Pentenenitrile	c16529661
1534	C₅H₇N	(Z)-2-Pentenenitrile	c25899507
1535	C₅H₇N	1H-Pyrrole, 1-methyl-	c96548
1536	C₅H₇N	Cyclobutanecarbonitrile	c4426113
1537	C₅H₉N	1,2,3,6-Tetrahydropyridine	c694053
1538	C₅H₉N	Butanenitrile, 2-methyl-	c18936179
1539	C₅H₉N	Pentanenitrile	c110598
1540	C₅H₉N	Propanenitrile, 2,2-dimethyl-	c630182
1541	C₆H₁₀	Bicyclo[3.1.0]hexane	c285585
1542	C₅H₁₁N	Cyclopentanamine	cypentam
1543	C₅H₁₁N	Piperidine	piper
1544	C₄H₁₂N₂	1,2-Butanediamine	c4426486
1545	C₄H₁₂N₂	2-Methyl-1,2-propanediamine	c811938
1546	Li₂CO₃	Lithium Carbonate	li2co3
1547	Na₂CO₃	Sodium Carbonate	na2co3
1548	C₂O₄^--	oxalate anion	c2o4
1549	MgSO₄	Magnesium Sulfate	mgso4
1550	N₂O₄	Dinitrogen tetroxide	n2o4
1551	C₃H₂O₃	vinylene carbonate	vica
1552	C₂H₂O₄	Oxalic Acid	oxalic
1553	C₂H₃NO₃	Oxamic acid	oxamic
1554	C₄H₄O₂	2(5H)-Furanone	furanone
1555	C₄H₄O₂	2-Oxetanone, 4-methylene-	c674828
1556	C₂H₄N₂O₂	Oxalamide	oxalamide
1557	C₂H₄N₂S₂	Ethanedithioamide	c79403
1558	C₂H₄CO₃	Ethylene carbonate	etco3
1559	C₃H₄O₂S	2H-Thiete-1,1-dioxide	c7285327
1560	C₃H₄S₃	1,3-Dithiolane-2-thione	c822388
1561	C₂H₄O₄	Formic acid dimer	fadimer
1562	C₄H₅NO	3-Methylisoxazole	isox3m
1563	C₄H₅NO	Isoxazole, 5-methyl-	c5765446
1564	C₄H₅NS	4-Methylthiazole	c693958
1565	C₂H₅NO₃	Nitric acid, ethyl ester	c625581
1566	C₅H₆O	2H-Pyran	pyran2
1567	C₅H₆O	2-methylfuran	furan2m
1568	C₅H₆O	3-Methylfuran	furan3m
1569	C₅H₆O	Pentadienal	pdal
1570	C₅H₆S	Thiophene, 2-methyl-	c554143
1571	C₅H₆S	Thiophene, 3-methyl-	c616444
1572	C₄H₆O₂	γ–Butyrolactone	c96480
1573	C₄H₆O₂	2,3-Butanedione	c431038
1574	C₄H₆O₂	2-Propenoic acid, methyl ester	c96333
1575	C₄H₆O₂	Crotonic Acid	crot
1576	C₄H₆OS	2,3-dihydrothiophene-2-ol	c9000117
1577	C₄H₆OS	2,5-dihydrothiophene-3-ol	c9000093
1578	C₄H₆OS	4,5-dihydrothiophene-2-ol	c9000106
1579	C₄H₆OS	4,5-dihydrothiophene-3-ol	c9000082
1580	C₄H₆OS	Dihydro-2-(3H)-thiophenone	c1003107
1581	C₄H₆OS	Dihydro-3-(2H)-thiophenone	c1003049
1582	C₄H₆OS	Vinyl sulfoxide	c1115157
1583	CH₆N₄S	Carbonothioic dihydrazide	thiacarb
1584	C₂H₆N₂O₂	(E)-Azodioxymethane	c37765154
1585	C₂H₆N₂O₂	Dimethylnitroamine	c4164287
1586	C₃H₆O₃	1,3,5-Trioxane	trioxane
1587	C₃H₆S₃	1,3,5-Trithiane	c3h6s3
1588	C₃H₆S₃	Carbonotrithioic acid, dimethyl ester	c2314489
1589	C₂H₆O₃S	Sulfurous acid, dimethyl ester	c616422
1590	C₄H₇NO	2-Pyrrolidinone	c616455
1591	C₄H₇NO	Ethoxyacetonitrile	etoaccn
1592	C₄H₇NO	Methacrylamide	c79390
1593	C₄H₇NO	Oxazole, 4,5-dihydro-2-methyl-	c1120645
1594	HCONH₂CN₂H₄	formamide aminomethanimine dimer	d13
1595	C₃H₇ONO	Propyl nitrite	prono
1596	CH₃CH(CH₃)ONO	Isopropyl nitrite	c541424
1597	CH₃CH(NH₂)COOH	Alanine	alanine
1598	CH₃NHCH₂COOH	Sarcosine	sarcosine
1599	NH₂CH₂CH₂COOH	β–alanine	betaalanine
1600	NH₂COOC₂H₅	Urethane	urethane
1601	C₅H₈O	2H-Pyran, 3,4-dihydro-	c110872
1602	C₅H₈O	Cyclopentanone	c120923
1603	C₅H₈O	Furan, 2,3-dihydro-5-methyl-	c1487156
1604	C₅H₈O	Methyl cyclopropyl ketone	c765435
1605	N(CH₃)₂CONH₂	Urea, N,N-dimethyl-	c598947
1606	NH(CH₃)CONH(CH₃)	Urea, N,N'-dimethyl-	c96311
1607	NH₂CONHC₂H₅	Urea, ethyl-	c625525
1608	C₄H₈O₂	1,3-Dioxane	dioxan13
1609	C₄H₈O₂	1,3-Dioxolane, 2-methyl-	c497267
1610	C₄H₈O₂	1,4-Dioxane	dioxan14
1611	C₄H₈O₂	Ethene, 1,1-dimethoxy-	c922690
1612	C₄H₈O₂	Ethyl acetate	c141786
1613	C₄H₈OS	s-Ethyl thioacetate	c625605
1614	C₃H₈O₃	1,2,3-Propanetriol	glycerin
1615	C₃H₈O₂S	(Methylsulfonyl)ethane	c594434
1616	C₄H₉NO	Butanamide	c541355
1617	C₄H₉NO	Propanamide, 2-methyl-	c563837
1618	C₅H₁₀O	2-Butanone, 3-methyl-	c563804
1619	C₅H₁₀O	2H-Pyran, tetrahydro-	c142687
1620	C₅H₁₀O	2-methylbutyraldehyde	2meba
1621	C₅H₁₀O	2-Pentanone	mpk
1622	C₅H₁₀O	3-Pentanone	dek
1623	C₅H₁₀O	Cyclopentanol	c96413
1624	C₅H₁₀O	Oxetane, 3,3-dimethyl-	c6921353
1625	C₅H₁₀O	Pentanal	pal
1626	C₅H₁₀S	2H-Thiopyran, tetrahydro-	c1613510
1627	C₅H₁₀S	3-Ethylthio-1-propene	c5296628
1628	C₅H₁₀S	Cyclopentanethiol	c1679078
1629	C₅H₁₀S	Thiophene, tetrahydro-2-methyl-	c1795091
1630	C₅H₁₀S	Thiophene, tetrahydro-3-methyl-	c4740005
1631	C₄H₁₀O₂	1,1-Dimethoxyethane	c534156
1632	C₄H₁₀O₂	1,3-Butanediol	budiol13
1633	C₄H₁₀O₂	1,4-Butanediol	budiol14
1634	C₄H₁₀O₂	Ethane, 1,2-dimethoxy-	c110714
1635	C₄H₁₀OS	Diethyl sulfoxide	c70291
1636	C₄H₁₀S₂	1,4-Butanedithiol	budisl14
1637	C₄H₁₁NO	Diethylhydroxylamine	c3710847
1638	C₅H₁₂O	1-Butanol, 2-methyl-	c137326
1639	C₅H₁₂O	1-Butanol, 3-methyl-	c123513
1640	C₅H₁₂O	1-Pentanol	pentanol1
1641	C₅H₁₂O	2-Butanol, 3-methyl-	c598754
1642	C₅H₁₂O	2-Pentanol	peol2
1643	C₅H₁₂O	3-Pentanol	pentan3ol
1644	C₅H₁₂O	Butane, 1-methoxy-	meobu
1645	C₅H₁₂O	Propane, 1-ethoxy-	proet
1646	C₅H₁₂O	Propane, 2-methoxy-2-methyl-	c1634044
1647	C₅H₁₂S	1-Butanethiol, 2-methyl-	c1878188
1648	C₅H₁₂S	1-Butanethiol, 3-methyl-	c541311
1649	C₅H₁₂S	1-Pentanethiol	c110667
1650	C₅H₁₂S	1-Propanethiol, 2,2-dimethyl-	c1679089
1651	C₅H₁₂S	2-Butanethiol, 2-methyl-	c1679090
1652	C₅H₁₂S	2-Butanethiol, 3-methyl-	c2084186
1653	C₅H₁₂S	Butane, 1-(methylthio)-	c628295
1654	C₅H₁₂S	Ethyl propyl sulfide	c4110503
1655	C₅H₁₂S	Propane, 2-(ethylthio)-	c5145993
1656	C₅H₁₂S	Propane, 2-methyl-2-(methylthio)-	c6163640
1657	C₄F₂	difluorobutadiyne	c4f2
1658	ClCOClCO	Oxalyl chloride	oxcl
1659	CF₃CN	Acetonitrile, trifluoro-	cf3cn
1660	CF₃CN⁺	Acetonitrile, trifluoro- cation	cf3cn+
1661	B₂F₄	Diboron tetrafluoride	b2f4
1662	B₂Cl₄	Diboron tetrachloride	b2cl4
1663	C₂F₄	Tetrafluoroethylene	c2f4
1664	C₂F₄⁺	Tetrafluoroethylene cation	c2f4+
1665	C₂ClF₃	Ethene, chlorotrifluoro-	c2f3cl
1666	CF₂CCl₂	difluorodichloroethylene	cf2ccl2
1667	CFClCClF	trans-1,2-dichloro-1,2-difluoroethylene	cfclcclf
1668	CFClCFCl	cis-1,2-dichloro-1,2-difluoroethylene	cfclcfcl
1669	C₂FCl₃	fluorotrichloroethene	c2fcl3
1670	C₂Cl₄	Tetrachloroethylene	c2cl4
1671	C₂Br₄	tetrabromoethene	c2br4
1672	CF₃OF	Trifluoromethylhypofluorite	cf3of
1673	SiF₅^-	silicon pentafluoride anion	sif5-
1674	SOF₄	Sulfur tetrafluoride oxide	sof4
1675	PF₅	Phosphorus pentafluoride	pf5
1676	AsF₅	Arsenic pentafluoride	asf5
1677	PCl₅	Phosphorus pentachloride	pcl5
1678	SF₅	Sulfur pentafluoride	sf5
1679	SF₅⁺	pentafluoro sulfur cation	sf5+
1680	SbCl₅	Antimony pentachloride	sbcl5
1681	BrF₅	bromine pentafluoride	brf5
1682	ClF₅	chlorinepentafluoride	clf5
1683	IF₅	pentafluoroiodine	if5
1684	CF₃CHO	trifluoroacetaldehyde	cf3cho
1685	CCl₃CHO	trichloroacetaldehyde	ccl3cho
1686	CHFClCHClF	ethane, 1,2-dichloro-1,2-difluoro-	chfclchclf
1687	CF₃CH₂F	1,1,1,2-tetrafluoroethane	cf3ch2f
1688	CHF₂CHF₂	1,1,2,2-tetrafluoroethane	chf2chf2
1689	CF₃CH₂Cl	2,2,2-Trifluoroethyl chloride	cf3ch2cl
1690	CHFClCHFCl	1,2-dichloro-1,2-difluoroethane RR	chfclchfcl
1691	CH₂ClCCl₃	1,1,1,2-tetrachloroethane	ch2clccl3
1692	CHCl₂CHCl₂	Ethane, 1,1,2,2-tetrachloro-	chcl2chcl2
1693	CH₂BrCBr₃	1,1,1,2-tetrabromo ethane	c2h2br4
1694	CHCl₂CHF₂	1,1-dichloro-2,2-difluoroethane	c2h2cl2f2
1695	CF₃COOH	trifluoroacetic acid	cf3cooh
1696	C₄H₃ClO	Furan, 2-chloro	fur2cl
1697	C₄H₃ClO	Furan,3-chloro	fur3cl
1698	C₃H₅ClO₂	Carbonochloridic acid, ethyl ester	c541413
1699	C₃H₅Cl₃	Propane, 1,2,3-trichloro-	prcl135
1700	C₄H₈Cl₂	1,4-Dichlorobutane	c110565
1701	C₄H₈Cl₂	Butane, 1,2-dichloro-	c616217
1702	C₄H₈Cl₂	Butane, 1,3-dichloro-	c1190223
1703	C₄H₈Cl₂	Butane, 2,3-dichloro-, (r,r)-(.+/-.)-	c2211678
1704	C₄H₈Cl₂	Butane, 2,3-dichloro-, (r,s)-	c4028562
1705	C₄H₉ClO	1-Chloro-2-ethoxyethane	c628342
1706	C₅H₁₁Cl	Pentane, 1-chloro-	pencl1
1707	C₄H₈O₂	Butanoic acid	bua
1708	C₆H₅CH₂	benzyl radical	benzyl
1709	C₇H₇	cycloheptatrienyl radical	c7h7
1710	C₇H₇⁺	cycloheptatrienyl cation	c7h7+
1711	C₆H₅CH₃	toluene	toluene
1712	C₇H₈	cycloheptatriene	cht
1713	C₇H₈	Norbornadiene	norbor
1714	C₇H₈	Quadricyclane	qucy
1715	C₇H₁₂	Norbornane	nor
1716	C₇H₁₄	cycloheptane	c7h14
1717	C₇H₁₆	2-methylhexane	2mhex
1718	C₇H₁₆	3-methylhexane	hex3m
1719	C₇H₁₆	heptane	heptane
1720	CH(CN)₃	tricyanomethane	mecn3
1721	HN=C=C(CN)₂	Dicyanoketenimine	c4hn3
1722	C₆H₇N	2-Methylpyridine	mp
1723	C₆H₅NH₂	aniline	aniline
1724	C₆H₁₃N	2-Methylpiperidine	pip2m
1725	C₆H₁₃N	cyclohexanamine	cham
1726	C₆H₁₅N	triethylamine	tea
1727	N₂O₅	Dinitrogen pentoxide	n2o5
1728	C₄H₂O₃	Maleic Anhydride	malan
1729	C₅H₄O₂	4-Cyclopentene-1,3-dione	cpdio
1730	C₅H₄O₂	furfural	furfural
1731	C₆H₅O	phenoxy radical	phenoxy
1732	C₅H₅NO	2(1H)-Pyridinone	c72762006
1733	C₅H₅NO	2(3H)-Pyridinone	c9000048
1734	C₅H₅NO	2(5H)-Pyridinone	c9000037
1735	C₅H₅NO	2-Pyridinol	c109104
1736	C₅H₅NO	3(2H)-Pyridinone	c9000004
1737	C₅H₅NO	3(4H)-Pyridinone	c9000026
1738	C₅H₅NO	3(6H)-Pyridinone	c9000015
1739	C₅H₅NO	3-Pyridinol	c109002
1740	C₅H₅NO	4(1H)-Pryidinone	c9000060
1741	C₅H₅NO	4(3H)-Pryidinone	c9000059
1742	C₅H₅NO	4-Pyridinol	c626642
1743	C₆H₅OH	phenol	phenol
1744	C₆H₆O	2,4-Cyclohexadienone	c24599573
1745	C₆H₆O	2,5-Cyclohexadienone	c5664335
1746	C₆H₅SH	Benzenethiol	phsh
1747	HO₂CCHNH₂CH₂OH	Serine	serine
1748	C₅H₈O₂	Acetylacetone	acac
1749	C₄H₈O₂S	Sulfolane	sulfolane
1750	C₇H₁₀	Norbornene	norbornene
1751	CH(C₂H₃)₃	trivinyl methane	tvm
1752	C₆H₁₀O	cyclohexanone	chexo
1753	C₆H₁₂O	hexanal	c6h12o
1754	C₆H₁₂O	Oxepane	oxepane
1755	C₃H₇OC₃H₇	di-n-propyl ether	propr
1756	F₂CCCF₂	tetrafluoroallene	pfa
1757	CF₃COO^-	trifluoro acetate anion	cf3coo-
1758	CF₃COF	trifluoroacetyl fluoride	cf3cof
1759	CF₃COCl	trifluoroacetyl chloride	cf3cocl
1760	PF₆	Hexafluorophosphate neutral	pf6
1761	PF₆^-	Hexafluorophosphate ion	pf6-
1762	SF₆	Sulfur Hexafluoride	sf6
1763	SeF₆	Selenium hexafluoride	sef6
1764	SF₅Cl	sulfur chloropentafluoride	sf5cl
1765	CF₃CHF₂	pentafluoroethane	cf3chf2
1766	CF₃CHFCl	1,1,1,2-tetrafluorochloroethane	cf3chfcl
1767	CF₃CHCl₂	1,1-Dichloro-2,2,2-trifluoroethane	cf3chcl2
1768	CHCl₂CClF₂	Ethane, 1,2,2-trichloro-1,1-difluoro-	chcl2cclf2
1769	CCl₃CHCl₂	pentachloroethane	ccl3chcl2
1770	C₆H₅F	Fluorobenzene	bzf
1771	C₆H₅Cl	chlorobenzene	bzcl
1772	C₆H₅Br	bromobenzene	bzbr
1773	C₈H₆	Calicene	calicene
1774	C₆H₅CCH	phenylacetylene	phac
1775	C₈H₆	benzocyclobutadiene	bcbd
1776	C₈H₆	Pentalene	pentalene
1777	C₆H₅CHCH₂	Styrene	styrene
1778	C₈H₈	cubane	cubane
1779	C₈H₈	cyclooctatetraene	cot
1780	C₆H₅CH₂CH₃	Ethylbenzene	etbz
1781	CH₃C₆H₄CH₃	meta-xylene	mxylene
1782	CH₃C₆H₄CH₃	paraxylene	pxylene
1783	C₈H₁₄	Bicyclo[2.2.2]octane	bico222
1784	C₈H₁₆	cyclooctane	cyclooct
1785	(CH₃)₃CC(CH₃)₃	tetramethylbutane	tmb
1786	C₈H₁₈	Octane	c8h18
1787	C₆H₅CN	phenyl cyanide	phcn
1788	C₆H₁₂N₂	Triethylenediamine	ted
1789	C₄O₄^--	squarate dianion	c4o4--
1790	S₄N₄	Tetrasulfur tetranitride	s4n4
1791	S₈	Octasulfur	s8
1792	C₆H₄O₂	parabenzoquinone	pbq
1793	C₄H₄N₂O₂	Uracil	uracil
1794	C₆H₅CHO	benzaldehyde	benzal
1795	C₆H₅OCH₃	Anisole	anisole
1796	C₅H₉NO₂	Proline	proline
1797	C₆H₁₂O₂	Methyl pivalate	c598981
1798	C₆H₁₂O₂	Hexanoic acid	hexa
1799	C₄F₄	tetrafluorcyclobutadiene	c4f4
1800	Al₂Cl₆	Aluminum, di-μ-chlorotetrachlorodi-	al2cl6
1801	CF₃CF₂Cl	pentafluorochloroethane	cf3cf2cl
1802	CF₂ClCF₂Cl	1,2-Dichloro-1,1,2,2-tetrafluoroethane	cf2clcf2cl
1803	CF₃CFCl₂	1,1-Dichlorotetrafluoroethane	cf3cfcl2
1804	CF₂ClCFCl₂	Ethane, 1,1,2-trichloro-1,2,2-trifluoro-	cf2clcfcl2
1805	CF₃CCl₃	1,1,1-trifluoro-2,2,2-trichloroethane	cf3ccl3
1806	C₂F₆	hexafluoroethane	c2f6
1807	C₂Cl₆	hexachloroethane	c2cl6
1808	IF₇	Iodine heptafluoride	if7
1809	C₆H₄F₂	metadifluorobenzene	mdfb
1810	C₆H₄F₂	orthodifluorobenzene	odfb
1811	C₆H₄F₂	1,4-difluorobenzene	pdfb
1812	C₆H₄Cl₂	1,2-dichlorobenzene	dcb12
1813	C₆H₄Cl₂	1,3-dichlorobenzene	dcb13
1814	C₆H₄Cl₂	1,4-dichlorobenzene	dcb14
1815	C₆H₅NO	nitrosobenzene	bzno
1816	C₉H₈	Indene	indene
1817	C₉H₈	spiro[4.4]nona-1,3,6,8-tetraene	snt
1818	C₉H₁₂	n-propyl benzene	prbz
1819	C₉H₂₀	Nonane	nonane
1820	C(CN)₄	tetracyanomethane	c5n4
1821	C₅H₄N₄	purine	purine
1822	C₈H₇N	Indole	indole
1823	C₆H₅NO₂	Nitrobenzene	c6h5no2
1824	C₆H₅COOH	benzoic acid	benzo
1825	CH₃COC₆H₅	acetophenone	acph
1826	C₃Cl₃N₃	1,3,5-Triazine, 2,4,6-trichloro-	c3cl3n3
1827	C₃F₆	hexafluoropropene	c3f6
1828	C₆H₃F₃	Benzene trifluoride 123	bzf3a
1829	C₈H₁₈O	1-Octanol	octanol
1830	C₁₀H₈	Azulene	azu
1831	C₁₀H₈	naphthalene	naph
1832	C₁₀H₁₀	bullvalene	bullv
1833	C₁₀H₁₆	adamantane	adamantane
1834	C₆N₄	Tetracyanoethylene	tcne
1835	C₆N₄^-	tetracyanoethylene anion	tcne-
1836	C₁₀H₂₂	Decane	decane
1837	C₄F₆	perfluorobutadiene	c4f6
1838	SF₅CF₃	Sulfur, pentafluoro(trifluoromethyl)-	sf5cf3
1839	C₃F₈	perfluoropropane	c3f8
1840	Fe(CO)₅	Iron pentacarbonyl	ipc
1841	Fe(C₅H₅)₂	ferrocene	fecp2
1842	B₁₂H₁₂^--	Dodecahydrododecaborate(2-)	b12h12--
1843	B₁₂H₁₂^--	Dodecahydrododecaborate(2-)	b12h12--
1844	C₁₂H₈	Acenaphthylene	acenaph
1845	C₁₂H₈	biphenylene	biph
1846	C₁₂H₁₀	biphenyl	biphenyl
1847	C₁₂H₁₀	Heptalene	heptalene
1848	C₆H₁₂O₆	Inositol	inositol
1849	C₆F₆	hexafluorobenzene	c6f6
1850	S₂F₁₀	disulphur decafluoride	s2f10
1851	C₁₃H₁₀	Fluorene	fluorene
1852	C₁₄H₁₀	Anthracene	anth
1853	C₁₄H₁₀	Phenanthrene	phenanthrene
1854	C₁₄H₁₄	Bibenzyl	bibenzyl
1855	C₁₂H₁₀N₂	azobenzene	azobenzene
1856	C₆H₅COC₆H₅	benzophenone	benzophenone
1857	C₁₆H₁₀	Pyrene	pyrene
1858	C₁₈H₁₂	Tetracene	tetracene
1859	C₁₉H₁₆	Triphenylmethane	tpm
1860	C₂₄H₁₂	Coronene	coronene
1861	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