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

List of which calculations are completed at B3LYPultrafine /cc-pCVTZ

count	Species	Name	State	Conformation
1	NaH	sodium hydride	¹Σ	C_∞v
2	NaH⁺	sodium hydride cation	²Σ	C_∞v
3	BeH	beryllium monohydride	²Σ	C_∞v
4	SiH	Silylidyne	²Π	C_∞v
5	CH₃	Methyl radical	²A₁	D_3h
6	CH₃^-	methyl anion	¹A₁	C_3v
7	CH₃⁺	methyl cation	¹A₁^'	D_3h
8	SiH₃	Silyl radical	²A₁	C_3v
9	SiH₄	Silane	¹A₁	T_d
10	HS	Mercapto radical	²Π	C_∞v
11	H₂S	Hydrogen sulfide	¹A₁	C_2v
12	H₂S⁺	Hydrogen sulfide cation	²B₁	C_2v
13	H₃S⁺	Sulfonium cation	¹A₁	C_3v
14	HCl	Hydrogen chloride	¹Σ	C_∞v
15	HCl⁺	hydrogen chloride cation	²Π	C_∞v
16	H₂Cl⁺	dihydrogen monochloride cation	¹A₁	C_2v
17	Li₂	Lithium diatomic	¹Σ_g	D_∞v
18	Na₂	Sodium diatomic	¹Σ_g	D_∞h
19	LiB	Lithium boride	³Π	C_∞v
20	NaAl	Sodium aluminum	¹Σ	C_∞v
21	Al₂H₆	dialane	¹A_G	D_2h
22	SiC	silicon monocarbide	³Σ	C_∞v
23	C₂H₄	Ethylene	¹A_g	D_2h
24	Si₂H₆	disilane	¹E_u	D_3d
25	CN	Cyano radical	²Σ	C_∞v
26	CN^-	cyanide anion	¹Σ	C_∞v
27	SiP	Silicon monophosphide	²Π	C_∞v
28	PN	Phosphorus mononitride	¹Σ	C_∞v
29	HCN	Hydrogen cyanide	¹Σ	C_∞v
30	NNH⁺	Dinitrogen monohydride cation	¹Σ	C_∞v
31	LiO	lithium oxide	²Σ	C_∞v
32	LiS	Lithium monosulfide	²Π	C_∞v
33	LiS⁺	Lithium sulfide cation	³Σ	C_∞v
34	NaO	sodium monoxide	²Σ	C_∞v
35	CaO	Calcium monoxide	¹Σ	C_∞v
36	CaS	Calcium sulfide	¹Σ	C_∞v
37	BO	boron monoxide	²Σ	C_∞v
38	CO	Carbon monoxide	¹Σ	C_∞v
39	CO^-	carbon monoxide anion	²Π	C_∞v
40	CO⁺	carbon monoxide cation	²Σ	C_∞v
41	NS	Mononitrogen monosulfide	²Π	C_∞v
42	PO	Phosphorus monoxide	²Π	C_∞v
43	PS	phosphorus sulfide	²Σ	C_∞v
44	O₂	Oxygen diatomic	³Σ_g	D_∞h
45	SO	Sulfur monoxide	³Σ	C_∞v
46	HO₂	Hydroperoxy radical	²A^"	C_s
47	SOH	Sulfur Hydroxide
48	HS₂	Thiosulfeno radical	²A^"	C_s
49	H₂CO	Formaldehyde	¹A₁	C_2v
50	H₂CS	Thioformaldehyde	¹A₁	C_2v
51	H₂S₂	Disulfane	¹A	C₂
52	H₂S₂⁺	hydrogen disulfide cation	²B_g	C_2h
53	H₂CSH⁺	Thioformaldehyde, protonated	¹A^'	C_s
54	CH₃SH	Methanethiol	¹A^'	C_s
55	CH₃SH⁺	Methanethiol cation	²A^"	C_s
56	CH₃SH₂⁺	protonated methylsulfide	¹A^'	C_s
57	LiF	lithium fluoride	¹Σ	C_∞v
58	LiCl	lithium chloride	¹Σ	C_∞v
59	NaF	sodium fluoride	¹Σ	C_∞v
60	NaCl	Sodium Chloride	¹Σ	C_∞v
61	BF	Boron monofluoride	¹Σ	C_∞v
62	CF	Fluoromethylidyne	²Π	C_∞v
63	SiF	silicon monofluoride	²Π	C_∞v
64	SiF⁺	silicon monofluoride cation	¹Σ	C_∞v
65	NCl	nitrogen monochloride	³Σ	C_∞v
66	ClO	Monochlorine monoxide	²Π	C_∞v
67	SF	Monosulfur monofluoride	²Π	C_∞v
68	SF⁺	sulfur monofluoride cation	³Σ	C_∞v
69	SCl	sulfur monochloride	²Π	C_∞v
70	SCl⁺	sulfur monochloride cation	³Σ_g	C_∞v
71	ClF	Chlorine monofluoride	¹Σ⁺	C_∞v
72	Cl₂⁺	chlorine diatomic cation	²Π_g	D_∞h
73	CH₂Cl	chloromethyl radical	²B₁	C_2v
74	CH₃F	Methyl fluoride	¹A₁	C_3v
75	CH₃Cl	Methyl chloride	¹A₁	C_3v
76	SiH₃Cl	chlorosilane	¹A₁	C₁
77	Si₃H₈	trisilane
78	LiCN	lithium cyanide	¹Σ	C*V LiCN
79	LiCN	lithium cyanide	¹A^'	C_s
80	LiCN	lithium cyanide	¹Σ	C*V LiNC
81	NaCN	Sodium Cyanide	¹Σ	C_∞v
82	NaCN	Sodium Cyanide	¹Σ	C_∞v
83	AlNC	Aluminum isocyanide
84	Li₂S	dilithium sulfide	¹Σ_G	D_∞h
85	Li₂S	dilithium sulfide	¹A₁	C_2v
86	Na₂O	disodium monoxide	¹Σ_g	Linear
87	Na₂O	disodium monoxide	¹A₁	C_2v
88	CCO	Dicarbon monoxide	³Σ	C_∞v
89	CO₂	Carbon dioxide	¹Σ_g	D_∞h
90	SiS₂	Silicon disulfide	¹Σ_G	D_∞h
91	NSO	sulfinyl amidogen
92	SNO	Nitrogen oxide sulfide
93	SO₂	Sulfur dioxide	¹A₁	C_2v
94	S₃⁺	Sulfur trimer cation	²B₂	C_2v
95	BH₃CO	Borane carbonyl	¹A₁	C_3v
96	CH₃SSH	Hydrogen methyl disulfide
97	CH₃CH₂SH	ethanethiol	¹A^'	C_s
98	CH₃CH₂SH	ethanethiol	¹A	C₁
99	FNS	Thionitrosyl fluoride	¹A^'	C_s
100	FSN	Thiazyl fluoride	¹A^'	C_s
101	OPCl	Phosphorus oxychloride
102	CF₂	Difluoromethylene	¹A₁	D_∞h
103	OClO	Chlorine dioxide	²B₁	D_∞h
104	ClSO	Sulfur chloride oxide	²A^"	C_s
105	FClO	chlorosyl fluoride	¹A^'	C_s
106	ClOF	Chlorine hypofluorite	¹A^'	C_s
107	SF₂	sulfur difluoride	¹A₁	C_2v
108	HCCF	Fluoroacetylene	¹Σ	C_∞v
109	CH₂F₂	Methane, difluoro-	¹A₁	C_2v
110	CH₂Cl₂	Methylene chloride	¹A₁	C_2v
111	S₂N₂	Disulfur dinitride	¹A_G	D_2h
112	CS₃^--	Carbonotrithioate
113	SO₃	Sulfur trioxide	¹A₁^'	D_3h
114	S₄	Sulfur tetramer
115	S₄	Sulfur tetramer
116	S₄	Sulfur tetramer
117	H₃AlO₃	Aluminum hydroxide
118	CF₂O	Carbonic difluoride	¹A₁	C_2v
119	BF₃	Borane, trifluoro-	¹A^'	D_3h
120	AlF₃	Aluminum trifluoride	¹A₁^'	D_3h
121	ClO₂F	Chloryl fluoride	¹A^'	C_s
122	SF₃	Sulfur trifluoride	²A^'	C_s
123	ClF₃	Chlorine trifluoride	¹A₁^'	D_3h
124	ClF₃	Chlorine trifluoride	¹A₁	C_2v
125	HClO₃	Chloric Acid	¹A	C₁
126	CHF₃	Methane, trifluoro-	¹A₁	C_3v
127	CF₃Cl	Methane, chlorotrifluoro-	¹A₁	C_3v
128	CF₂Cl₂	difluorodichloromethane	¹A₁	C_2v
129	SF₄	Sulfur tetrafluoride	¹A₁	C_2v
130	SiF₅^-	silicon pentafluoride anion
131	PF₅	Phosphorus pentafluoride	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	h
5	H^-	Hydrogen atom anion	h-
6	H⁺	Hydrogen atom cation	h+
7	D₂	Deuterium diatomic	d2
8	H₂	Hydrogen diatomic	h2
9	H₂^-	hydrogen diatomic anion	h2-
10	H₂⁺	Hydrogen cation	h2+
11	HD	Deuterium hydride	hd
12	H₃⁺	hydrogen trimer cation	h3+
13	He	Helium atom	he
14	He^-	Helium atom anion	he-
15	He⁺	Helium atom cation	he+
16	HeH	Helium hydride	heh
17	HeH⁺	Helium hydride cation	heh+
18	He₂⁺	helium diatomic cation	he2+
19	Li	Lithium atom	li
20	Li^-	Lithium atom anion	li-
21	Li⁺	Lithium atom cation	li+
22	Na	Sodium atom	na
23	Na^-	Sodium atom anion	na-
24	Na⁺	Sodium atom cation	na+
25	K	Potassium atom	k
26	K^-	Potassium atom anion	k-
27	K⁺	Potassium atom cation	k+
28	Cu	Copper atom	cu
29	Cu^-	Copper atom anion	cu-
30	Cu⁺	Copper atom cation	cu+
31	LiH	Lithium Hydride	lih
32	LiH^-	lithium hydride anion	lih-
33	LiH⁺	lithium hydride cation	lih+
34	NaH^-	sodium hydride anion	nah-
35	KH	Potassium hydride	kh
36	KH⁺	Potassium hydrogen cation	kh+
37	CuH	Copper monohydride	cuh
38	Be	Beryllium atom	be
39	Be^-	Beryllium atom anion	be-
40	Be⁺	Beryllium atom cation	be+
41	Mg	Magnesium atom	mg
42	Mg^-	Magnesium atom anion	mg-
43	Mg⁺	Magnesium atom cation	mg+
44	Ca	Calcium atom	ca
45	Ca^-	Calcium atom anion	ca-
46	Ca⁺	Calcium atom cation	ca+
47	Zn	Zinc atom	zn
48	Zn^-	Zinc atom anion	zn-
49	Zn⁺	Zinc atom cation	zn+
50	BeH^-	berylium monohydride anion	beh-
51	BeH⁺	beryllium monohydride cation	beh+
52	MgH	magnesium monohydride	mgh
53	MgH^-	magnesium monohydride anion	mgh-
54	MgH⁺	magnesium monohydride cation	mgh+
55	CaH	Calcium monohydride	cah
56	CaH⁺	Calcium monohydride cation	cah+
57	TiH	Titanium monohydride	tih
58	ZnH	Zinc monohydride	znh
59	ZnH⁺	Zinc, protonated	znh+
60	BeH₂	beryllium dihydride	beh2
61	BeH₂⁺	Beryllium dihydride cation	beh2+
62	MgH₂	magnesium dihydride	mgh2
63	CaH₂	Calcium Hydride	cah2
64	ZnH₂	Zinc hydride	znh2
65	B	Boron atom	b
66	B^-	Boron atom anion	b-
67	B⁺	Boron atom cation	b+
68	Al	Aluminum atom	al
69	Al^-	Aluminum atom anion	al-
70	Al⁺	Aluminum atom cation	al+
71	Sc	Scandium atom	sc
72	Sc⁺	Scandium cation	sc+
73	Ga	Gallium atom	ga
74	Ga^-	Gallium atom anion	ga-
75	Ga⁺	Gallium atom cation	ga+
76	BH	Boron monohydride	bh
77	BH^-	boron monohydride anion	bh-
78	BH⁺	boron monohydride cation	bh+
79	AlH	aluminum monohydride	alh
80	AlH^-	aluminum monohydride anion	alh-
81	AlH⁺	aluminum monohydride cation	alh+
82	ScH	Scandium monohydride	sch
83	ScH⁺	Scandium monohydride cation	sch+
84	GaH	Gallium monohydride	gah
85	GaH⁺	Gallium monohydride cation	gah+
86	BH₂	boron dihydride	bh2
87	BH₂^-	boron dihydride anion	bh2-
88	BH₂⁺	Boron dihydride cation	bh2+
89	AlH₂	aluminum dihydride	alh2
90	AlH₂^-	aluminum dihydride anion	alh2-
91	AlH₂⁺	aluminum dihydride cation	alh2+
92	BH₃	boron trihydride	bh3
93	BH₃^-	boron trihydride anion	bh3-
94	BH₃⁺	boron trihydride cation	bh3+
95	AlH₃	aluminum trihydride	alh3
96	AlH₃^-	aluminum trihydride anion	alh3-
97	AlH₃⁺	aluminum trihydride cation	alh3+
98	ScH₃	Scandium trihydride	sch3
99	GaH₃	Gallium trihydride	gah3
100	BH₄	borohydride	bh4
101	BH₄^-	borohydride anion	bh4-
102	AlH₄^-	Aluminum tetrahydride anion	alh4-
103	C	Carbon atom	c
104	C^-	Carbon atom anion	c-
105	C⁺	Carbon atom cation	c+
106	Si	Silicon atom	si
107	Si^-	Silicon atom anion	si-
108	Si⁺	Silicon atom cation	si+
109	Ti	Titanium atom	ti
110	Ti^-	Titanium atom anion	ti-
111	Ti⁺	Titanium atom cation	ti+
112	Ge	Germanium atom	ge
113	Ge^-	Germanium anion	ge-
114	Ge⁺	Germanium cation	ge+
115	Sn	Tin atom	sn
116	Sn⁺	Tin cation	sn+
117	CH	Methylidyne	ch
118	CH^-	methylidyne anion	ch-
119	CH⁺	Methylidyne cation	ch+
120	SiH^-	silicon monohydride anion	sih-
121	SiH⁺	silicon monohydride cation	sih+
122	GeH	germylidene	geh
123	GeH⁺	Germaniun monohyrdide cation	geh+
124	CH₂	Methylene	ch2
125	CH₂^-	methylene anion	ch2-
126	CH₂⁺	methylene cation	ch2+
127	SiH₂	silicon dihydride	sih2
128	SiH₂^-	silicon dihydride anion	sih2-
129	SiH₂⁺	silicon dihydride cation	sih2+
130	GeH₂	germylene	geh2
131	GeH₂^-	germylene anion	geh2-
132	SiH₃^-	Silyl anion	sih3-
133	SiH₃⁺	Silyl cation	sih3+
134	GeH₃	Germyl radical	geh3
135	GeH₃⁺	germyl cation	geh3+
136	CD₄	methane-d4	cd4
137	CH₂D₂	methane-d2	ch2d2
138	CH₃D	methane-d	ch3d
139	CH₄	Methane	ch4
140	CH₄^-	Methane anion	ch4-
141	CH₄⁺	Methane cation	ch4+
142	CHD₃	methane-d3	chd3
143	SiH₂D₂	silane-d2	sih2d2
144	SiH₄⁺	Silane cation	sih4+
145	GeH₄	Germane	geh4
146	SnH₄	Stannane	snh4
147	SiH₅⁺	Silane, protonated	sih5+
148	N	Nitrogen atom	n
149	N^-	Nitrogen atom anion	n-
150	N⁺	Nitrogen atom cation	n+
151	P	Phosphorus atom	p
152	P^-	Phosphorus atom anion	p-
153	P⁺	Phosphorus atom cation	p+
154	V	Vanadium atom	v
155	V⁺	Vanadium atom cation	v+
156	As	Arsenic atomic	as
157	As^-	Arsenic anion	as-
158	As⁺	Arsenic cation	as+
159	Sb	Antimony atom	sb
160	NH	Imidogen	nh
161	NH^-	Imidogen anion	nh-
162	NH⁺	imidogen cation	nh+
163	PH	phosphorus monohydride	ph
164	PH^-	phosphorus monohydride anion	ph-
165	PH⁺	phosphorus monohydride cation	ph+
166	AsH	Arsenic monohydride	ash
167	AsH⁺	Arsenic monohydride cation	ash+
168	SbH	Antimony monohydride	sbh
169	ND₂	Amidogen-d2	nd2
170	NH₂	Amino radical	nh2
171	NH₂^-	amino anion	nh2-
172	NH₂⁺	Amino cation	nh2+
173	PH₂	Phosphino radical	ph2
174	PH₂^-	Phosphino anion	ph2-
175	PH₂⁺	Phosphino cation	ph2+
176	AsH₂	Arsenic dihydride	ash2
177	AsH₂⁺	Arsenic dihydride cation	ash2+
178	ND₃	Ammonia-d3	nd3
179	NH₃	Ammonia	nh3
180	NH₃^-	Ammonia anion	nh3-
181	NH₃⁺	ammonia cation	nh3+
182	PH₃	Phosphine	ph3
183	PH₃⁺	Phosphine cation	ph3+
184	AsH₃	Arsine	ash3
185	AsH₃⁺	Arsine cation	ash3+
186	SbH₃	Stibine	sbh3
187	AsH₄⁺	Arsonium	ash4+
188	NH₄	Ammonium radical	nh4
189	NH₄⁺	ammonium cation	nh4+
190	PH₄	Phosphoranyl radical	ph4
191	PH₄⁺	phosphonium cation	ph4+
192	O	Oxygen atom	o
193	O^-	Oxygen atom anion	o-
194	O⁺	Oxygen atom cation	o+
195	S	Sulfur atom	s
196	S^-	Sulfur atom anion	s-
197	S⁺	Sulfur atom cation	s+
198	Cr	Chromium atom	cr
199	Se	Selenium atom	se
200	Se^-	Selenium atom anion	se-
201	Se⁺	Selenium atom cation	se+
202	Te	Tellurium atom	te
203	Te⁺	Tellurium atom cation	te+
204	DO	Hydroxyl-d	od
205	OH	Hydroxyl radical	oh
206	OH^-	hydroxide anion	oh-
207	OH⁺	hydoxyl cation	oh+
208	DS	Mercapto-d	ds
209	HS^-	mercapto anion	sh-
210	HS⁺	sulfur monohydride cation	sh+
211	CrH	Chromium hydride	crh
212	CrH⁺	Chromium hydride cation	crh+
213	HSe	Selenium monohydride	hse
214	HSe^-	selenium monohydride anion	hse-
215	HSe⁺	selenium monohydride cation	hse+
216	TeH	Telluryl radical	teh
217	D₂O	Deuterium oxide	d2o
218	H₂O	Water	h2o
219	H₂O^-	water anion	h2o-
220	H₂O⁺	water cation	h2o+
221	HDO	Water-d1	hdo
222	D₂S	Hydrogen sulfide-d2	d2s
223	H₂S^-	Hydrogen sulfide anion	h2s-
224	H₂Se	Hydrogen selenide	h2se
225	H₂Se⁺	Hydrogen selenide cation	h2se+
226	H₂Te	Hydrogen Telluride	h2te
227	H₃O⁺	hydronium cation	h3o+
228	H₃Se⁺	Hydrogen Selenide, protonated	h3se+
229	F	Fluorine atom	f
230	F^-	Fluorine atom anion	f-
231	F⁺	Fluorine atom cation	f+
232	Cl	Chlorine atom	cl
233	Cl^-	Chlorine atom anion	cl-
234	Cl⁺	Chlorine atom cation	cl+
235	Mn	Manganese atom	mn
236	Br	Bromine atom	br
237	Br^-	Bromine atom anion	br-
238	Br⁺	Bromine atom cation	br+
239	I	Iodine atom	iodine
240	I^-	Iodine atom anion	iodine-
241	I⁺	Iodine atom cation	iodine+
242	DF	Hydrofluoric acid-d	df
243	HF	Hydrogen fluoride	hf
244	HF^-	hydrogen fluoride anion	hf-
245	HF⁺	hydrogen fluoride cation	hf+
246	DCl	Hydrochloric acid-d	dcl
247	HCl^-	hydrogen chloride anion	hcl-
248	HBr	hydrogen bromide	hbr
249	HBr^-	hydrogen bromide anion	hbr-
250	HBr⁺	hydrogen bromide cation	hbr+
251	HI	Hydrogen iodide	hi
252	HI⁺	Hydrogen iodide cation	hi+
253	H₂F⁺	dihydrogen fluoride cation	h2f+
254	H₂Br⁺	protonated hydrogen bromide	h2br+
255	H₂I⁺	Iodonium	h2i+
256	Ne	Neon atom	ne
257	Ne^-	Neon atom anion	ne-
258	Ne⁺	Neon atom cation	ne+
259	Ar	Argon atom	ar
260	Ar^-	Argon atom anion	ar-
261	Ar⁺	Argon atom cation	ar+
262	Fe	Iron atom	fe
263	Kr	Krypton atom	kr
264	Kr⁺	Krypton cation	kr+
265	Xe	Xenon atom	xe
266	HeLi⁺	Helium Lithium cation	heli+
267	NeH	neon hydrogen	neh
268	NeH⁺	neon hydrogen cation	neh+
269	ArH⁺	Argon hydride cation	arh+
270	KrH⁺	Protonated Krypton	krh+
271	XeH⁺	Xenon, protonated	xeh+
272	H₂Ar	H2 Ar dimer	h2ar
273	Co	Cobalt atom	cobalt
274	Ni	Nickel atom	ni
275	Li₂^-	lithium diatomic anion	li2-
276	Li₂⁺	lithium diatomic cation	li2+
277	NaLi	lithium sodium	lina
278	NaLi^-	lithium sodium anion	lina-
279	NaLi⁺	lithium sodium cation	lina+
280	LiK	Lithium Potassium	lik
281	Na₂^-	sodium diatomic anion	na2-
282	Na₂⁺	sodium diatomic cation	na2+
283	NaK	Sodium Potassium	nak
284	NaK⁺	Sodium Potassium diatomic cation	nak+
285	K₂	Potassium diatomic	k2
286	Cu₂	Copper diatomic	cu2
287	LiBe	Lithium Beryllium	libe
288	LiMg	Lithium magnesium	limg
289	NaBe	Sodium Beryllium	nabe
290	NaMg	Sodium Magnesium	namg
291	Be₂	Beryllium diatomic	be2
292	Be₂^-	Beryllium diatomic anion	be2-
293	Be₂⁺	Beryllium diatomic cation	be2+
294	BeMg	Beryllium Magnesium	bemg
295	Mg₂	Magnesium diatomic	mg2
296	Mg₂^-	magnesium diatomic anion	mg2-
297	Mg₂⁺	magnesium diatomic cation	mg2+
298	Ca₂	Calcium diatomic	ca2
299	LiAl	Lithium Aluminum	lial
300	BeB	Beryllium monoboride	beb
301	B₂	Boron diatomic	b2
302	B₂^-	Boron diatomic anion	b2-
303	B₂⁺	Boron diatomic cation	b2+
304	BAl	Boron Aluminum	bal
305	Al₂	Aluminum diatomic	al2
306	Al₂^-	aluminum diatomic anion	al2-
307	Al₂⁺	aluminum diatomic cation	al2+
308	BGa	Boron Gallium	bga
309	AlGa	Aluminum Gallium	alga
310	Ga₂	Gallium diatomic	ga2
311	HBBH	Diborane(2)	hbbh
312	LiBH₄	Lithium borohydride	libh4
313	B₂H₄	Diborane(4) D2d	b2h4
314	HBHHBH	Diborane(4) C2V	hbhhbh
315	B₂H₆	Diborane	b2h6
316	B₂H₆⁺	Diborane cation	b2h6
317	Ga₂H₆	digallane	ga2h6
318	LiC	Lithium Carbide	lic
319	BeC	Beryllium Carbide	bec
320	CaC	Calcium monocarbide	cac
321	BC	boron monocarbide	bc
322	BC^-	boron monocarbide anion	bc-
323	BC⁺	boron monocarbide cation	bc+
324	AlC	Aluminum carbide	alc
325	BSi	Boron silicide	bsi
326	C₂	Carbon diatomic	c2
327	C₂^-	carbon diatomic anion	c2-
328	C₂⁺	carbon diatomic cation	c2+
329	SiC^-	silicon monocarbide anion	sic-
330	SiC⁺	silicon monocarbide cation	sic+
331	Si₂	Silicon diatomic	si2
332	Si₂^-	silcon diatomic anion	si2-
333	Si₂⁺	silcon diatomic cation	si2+
334	GeC	Germanium monocarbide	gec
335	SiGe	Silicon Germanium	sige
336	Ge₂	Germanium diatomic	ge2
337	C₂H	Ethynyl radical	c2h
338	C₂H^-	Ethynyl anion	c2h-
339	C₂H⁺	Ethynyl cation	c2h+
340	ZnCH₂	Zinc methylene	znch2
341	C₂H₂	Acetylene	c2h2
342	C₂H₂⁺	acetylene cation	c2h2+
343	CCH₂	vinylidene	vinylidene
344	H₂CC^-	vinylidene anion	h2cc-
345	HCCH^-	acetylene anion	c2h2-
346	Si₂H₂	disilyne	si2h2
347	CH₃Li	methyl lithium	ch3li
348	CuCH₃	monomethyl copper	cuch3
349	ZnCH₃	Zinc monomethyl	znch3
350	CH₂BH	methyleneborane	ch2bh
351	C₂H₃	vinyl	c2h3
352	C₂H₃^-	vinyl anion	c2h3-
353	C₂H₃⁺	vinyl cation	c2h3+
354	C₂H₄^-	Ethylene anion	c2h4-
355	C₂H₄⁺	Ethylene cation	c2h4+
356	CH₃CH	methylmethylene	ch3ch
357	CH₂SiH₂	silaethylene	ch2sih2
358	Si₂H₄	Disilene	si2h4
359	CH₃BH₂	methylborane	ch3bh2
360	C₂H₅	Ethyl radical	c2h5
361	C₂H₅^-	Ethyl anion	c2h5-
362	C₂H₅⁺	Ethyl cation	c2h5+
363	C₂H₆	Ethane	c2h6
364	C₂H₆⁺	ethane cation	c2h6+
365	CH₃SiH₃	methyl silane	ch3sih3
366	GeH₃CH₃	methyl germane	geh3ch3
367	C₂H₇⁺	Ethane, protonated	c2h7+
368	LiN	Lithium Nitride	lin
369	LiN⁺	Lithium Nitride cation	lin+
370	LiP	Lithium monophosphide	lip
371	BeN	Beryllium mononitride	ben
372	BeN^-	Beryllium mononitride anion	ben-
373	BeN⁺	Beryllium mononitride cation	ben+
374	MgN	Magnesium Nitride	mgn
375	BN^-	boron nitride anion	bn-
376	AlN^-	aluminum mononitride anion	aln-
377	AlN⁺	aluminum mononitride cation	aln+
378	BP	Boron monophosphide	bp
379	AlP	Aluminum monophosphide	alp
380	GaN	Gallium mononitride	gan
381	GaP	Gallium monophosphide	gap
382	GaAs	Gallium arsenide	gaas
383	BN	boron nitride	bn
384	BN⁺	boron nitride cation	bn+
385	AlN	Aluminum nitride	aln
386	CN⁺	Cyano cation	cn+
387	CP	Carbon monophosphide	cp
388	CP^-	carbon monophosphide anion	cp-
389	CP⁺	carbon monophosphide cation	cp+
390	SiN	Silicon nitride	sin
391	SiN^-	silicon mononitride anion	sin-
392	SiN⁺	silicon mononitride cation	sin+
393	SiP^-	Silicon monophosphide anion	sip-
394	SiP⁺	Silicon monophosphide cation	sip+
395	TiN	Titanium mononitride	tin
396	N₂	Nitrogen diatomic	n2
397	N₂^-	nitrogen diatomic anion	n2-
398	N₂⁺	diatomic nitrogen cation	n2+
399	PN^-	phosphorus nitride anion	pn-
400	PN⁺	phosphorus nitride cation	pn+
401	P₂	Phosphorus diatomic	p2
402	P₂^-	phosphorus diatomic anion	p2-
403	P₂⁺	phosphorus diatomic cation	p2+
404	AsN	Arsenic mononitride	asn
405	AsP	Arsenic monophosphide	asp
406	SbN	Antimony nitride	sbn
407	As₂	Arsenic diatomic	as2
408	HNB	hydrogen nitrogen boron	hnb
409	HNC	hydrogen isocyanide	hnc
410	HCN^-	Hydrogen cyanide anion	hcn-
411	HCN⁺	hydrogen cyanide cation	hcn+
412	HNC⁺	hydrogen isocyanide cation	hnc+
413	HCP	Phosphaethyne	hcp
414	HCP⁺	Phosphaethyne cation	hcp+
415	NNH	Dinitrogen monohydride	nnh
416	HPO	Hydrogen phosphorus oxide	hpo
417	HPO⁺	Hydrogen phosphorus oxide cation	hpo+
418	LiNH₂	lithium amide	linh2
419	HBNH	Boranimine	hbnh
420	CNH₂	Aminomethylidyne radical	cnh2
421	CNH₂⁺	N-protonated hydrogen isocyanide	cnh2+
422	H₂CN	Dihydrogen cyanide radical	h2cn
423	H₂CN⁺	hydrocyanonium cation	h2cn+
424	HCNH	methyleneazane	hcnh
425	HCNH⁺	N-protonated HCN	hcnh+
426	H₂NN	Isodiazene	h2nn
427	N₂H₂	(E)-diazene	n2h2
428	N₂H₂	(Z)-Diazene	n2h2z
429	N₂H₂⁺	trans-diazene cation	n2h2+
430	CH₂NH	Methanimine	ch3n
431	CH₂NH⁺	Methanimine cation	ch2nh+
432	CHNH₂	aminomethylene	chnh2
433	CHNH₂⁺	Aminocarbene cation	chnh2+
434	CH₂PH	Phosphaethene	ch3p
435	BH₂NH₂	Boranamine	bh2nh2
436	CH₂NH₂⁺	methyleneamine cation	ch2nh2+
437	N₂H₄	Hydrazine	n2h4
438	N₂H₄⁺	hydrazine cation	n2h4+
439	P₂H₄	Diphosphine	p2h4
440	CH₃NH₂	methyl amine	ch3nh2
441	CH₃NH₂⁺	methyl amine cation	ch3nh2+
442	CH₃PH₂	Methyl phosphine	ch3ph2
443	SiH₃NH₂	Silane, amino	sih3nh2
444	N₂H₅⁺	protonated hydrazine	n2h5+
445	BH₃PH₃	borane phosphine	bh3ph3
446	BH₃NH₃	borane ammonia	bh3nh3
447	CH₃NH₃	methyl ammonium radical	ch3nh3
448	CH₃NH₃⁺	protonated methylamine	ch3nh3+
449	CH₃PH₃⁺	methyl phosphine, protonated	ch3ph3+
450	NH₃NH₃	Ammonia Dimer	nh3nh3
451	N₂H₇⁺	ammonia ammonium dimer	n2h7+
452	LiO^-	lithium oxide anion	lio-
453	LiO⁺	lithium oxide cation	lio+
454	NaO^-	sodium oxide anion	nao-
455	NaO⁺	sodium oxide cation	nao+
456	KO	Potassium monoxide	ko
457	KO⁺	Potassium monoxide cation	ko+
458	NaS	Sodium sulfide	nas
459	CuO	Copper Monoxide	cuo
460	LiSe	Lithium monoselenide	lise
461	BeO	beryllium oxide	beo
462	BeO^-	Beryllium monoxide anion	beo-
463	BeO⁺	Beryllium monoxide cation	beo+
464	BeS	beryllium sulfide	bes
465	MgO	magnesium oxide	mgo
466	MgO^-	magnesium oxide anion	mgo-
467	MgO⁺	magnesium oxide cation	mgo+
468	MgS	magnesium sulfide	mgs
469	MgS^-	magnesium sulfide anion	mgs-
470	MgS⁺	magnesium sulfide cation	mgs+
471	ZnO	zinc monoxide	zno
472	ZnS	Zinc sulfide	zns
473	BeS^-	Beryllium monosulfide anion	bes-
474	BeS⁺	Beryllium monosulfide cation	bes+
475	BO^-	boron monoxide anion	bo-
476	AlO	Aluminum monoxide	alo
477	AlO^-	Aluminum monoxide anion	alo-
478	AlO⁺	aluminum monoxide cation	alo+
479	BS	boron sulfide	bs
480	BS^-	boron monosulfide anion	bs-
481	BS⁺	boron monosulfide cation	bs+
482	AlS	Aluminum sulfide	als
483	AlS^-	aluminum monosulfide anion	als-
484	AlS⁺	aluminum monosulfide cation	als+
485	ScO	Scandium monoxide	sco
486	GaO	Gallium monoxide	gao
487	GaS	Gallium monosulfide	gas
488	BO⁺	boron monoxide cation	bo+
489	CS	carbon monosulfide	cs
490	CS^-	carbon monosulfide anion	cs-
491	CS⁺	carbon monosulfide cation	cs+
492	SiO	Silicon monoxide	sio
493	SiO^-	silicon monoxide anion	sio-
494	SiO⁺	silicon monoxide cation	sio+
495	SiS	silicon monosulfide	sis
496	SiS^-	silicon monosulfide anion	sis-
497	SiS⁺	silicon monosulfide cation	sis+
498	TiO	Titanium monoxide	tio
499	CSe	Carbon monoselenide	cse
500	CSe^-	Carbon monoselenide anion	cse-
501	CSe⁺	Carbon monoselenide cation	cse+
502	GeO	Germanium monoxide	geo
503	GeO⁺	Germanium monoxide cation	geo+
504	GeS	Germanium monosulfide	ges
505	SiSe	Silicon Monoselenide	sise
506	SiSe⁺	Silicon Monoselenide cation	sise+
507	GeSe	Germanium monoselenide	gese
508	NO	Nitric oxide	no
509	NO^-	nitric oxide anion	no-
510	NO⁺	nitric oxide cation	no+
511	NS^-	nitrogen sulfide anion	ns-
512	NS⁺	nitrogen sulfide cation	ns+
513	PO^-	phosphorus monoxide anion	po-
514	PO⁺	phosphorus monoxide cation	po+
515	PS^-	phosphorus monosulfide anion	ps-
516	PS⁺	phosphorus monosulfide cation	ps+
517	VO	Vanadium monoxide	vo
518	AsO	Arsenic monoxide	aso
519	NSe	Nitrogen monoselenide	nse
520	AsS	Arsenic monosulfide	ass
521	PSe	Phosphorus monoselenide	pse
522	AsSe	Arsenic monoselenide	asse
523	O₂^-	oxygen diatomic anion	o2-
524	O₂^--	dioxygen dianion	o2--
525	O₂⁺	diatomic oxygen cation	o2+
526	SO^-	sulfur monoxide anion	so-
527	SO⁺	sulfur monoxide cation	so+
528	S₂	Sulfur diatomic	s2
529	S₂^-	sulfur diatomic anion	s2-
530	S₂⁺	sulfur diatomic cation	s2+
531	SeO	Selenium monoxide	seo
532	SeO^-	selenium monoxide anion	seo-
533	SeO⁺	selenium monoxide cation	seo+
534	SeS	Selenium monosulfide	ses
535	SeS^-	selenium monosulfide anion	ses-
536	SeS⁺	selenium monosulfide cation	ses+
537	TeO	Tellurium monoxide	teo
538	Se₂	Selenium diatomic	se2
539	Se₂^-	selenium diatomic anion	se2-
540	Se₂⁺	selenium diatomic cation	se2+
541	Te₂	Tellurium diatomic	te2
542	LiOH	lithium hydroxide	lioh
543	NaOH	sodium hydroxide	naoh
544	KOH	Potassium hydroxide	koh
545	BeOH	beryllium monohydroxide	beoh
546	MgOH	magnesium hydroxide	mgoh
547	CaOH	Calcium monohydroxide	caoh
548	HBO	Boron hydride oxide	hbo
549	HBS	hydrogen boron sulfide	hbs
550	COH	Hydroxymethylidyne	coh
551	COH⁺	Carbon Monoxide, protonated	coh+
552	HCO	Formyl radical	hco
553	HCO^-	formyl anion	hco-
554	HCO⁺	Formyl cation	hco+
555	HCS	Thioformyl radical	hcs
556	HCS^-	Thioformyl anion	hcs-
557	HCS⁺	Thioformyl cation	hcs+
558	HNO	Nitrosyl hydride	hno
559	HNO^-	Nitrosyl hydride anion	hno-
560	HNO⁺	Nitrosyl hydride cation	hno+
561	NOH	Hydroxyimidogen	noh
562	NOH⁺	O-protonated nitric oxide	noh+
563	HNS	Sulfur imide	hns
564	HNS^-	Sulfur imide anion	hns-
565	HO₂^-	Hydroperoxy anion	ho2-
566	HO₂⁺	Hydroperoxy cation	ho2+
567	HSO⁺	Sulfur Monoxide, S-protonated	HSO+
568	SOH⁺	Sulfur Monoxide, protonated	soh+
569	H₂CO^-	formaldehyde anion	h2co-
570	H₂CO⁺	formaldehyde cation	h2co+
571	HOCH	hydroxycarbene	hoch
572	H₂CS^-	thioformaldehyde anion	h2cs-
573	H₂CS⁺	thioformaldehyde cation	h2cs+
574	H₂CSe	Selenoformaldehyde	h2cse
575	H₂NO	nitroxide	h2no
576	H₂O₂	Hydrogen peroxide	h2o2
577	H₂O₂⁺	Hydrogen peroxide cation	h2o2+
578	H₂OO	water oxide	h2oo
579	HOSH	hydrogen thioperoxide	hosh
580	H₂Se₂	hydrogen diselenide	h2se2
581	CH₂OH	Hydroxymethyl radical	ch2oh
582	CH₂OH⁺	hydroxymethyl cation	ch2oh+
583	CH₃O	Methoxy radical	ch3o
584	CH₃O^-	methoxy anion	ch3o-
585	CH₃O⁺	Methoxy cation	ch3o+
586	CH₃S	thiomethoxy	ch3s
587	NH₂OH	hydroxylamine	nh2oh
588	NH₂OH⁺	Hydroxylamine cation	nh2oh+
589	NH₃O	Ammonia Oxide	nh3o
590	H₂POH	Phosphinous acid	h2poh
591	H₃PO	Phosphine oxide	h3po
592	NH₂SH	Thiohydroxylamine	nh2sh
593	NH₃S	sulfidoazane	nh3s
594	H₃O₂⁺	hydrogen peroxide, protonated	h3o2+
595	CH₃OH	Methyl alcohol	ch3oh
596	CH₃OH^-	Methyl alcohol anion	ch3oh-
597	CH₃OH⁺	Methyl alcohol cation	ch3oh+
598	SiH₃OH	silanol	sih3oh
599	CH₃SeH	Methane selenol	ch3seh
600	NH₂OH₂⁺	protonated hydroxylamine	nh2oh2+
601	NH₃OH⁺	N-protonated hydroxylamine	nh3oh+
602	H₂OH₂O	water dimer	h2oh2o
603	CH₃OH₂⁺	Methanol, protonated	ch3oh2+
604	H₂ONH₃	Water Ammonia Dimer	h2onh3
605	H₅O₂⁺	Dihydroxonium ion	h5o2+
606	LiCl^-	lithium chloride anion	licl-
607	LiCl⁺	lithium chloride cation	licl+
608	NaF^-	sodium fluoride anion	naf-
609	NaF⁺	sodium fluoride cation	naf+
610	KF	Potassium Fluoride	kf
611	NaCl^-	sodium chloride anion	nacl-
612	NaCl⁺	sodium chloride cation	nacl+
613	KCl	Potassium Chloride	kcl
614	CuF	Copper monofluoride	cuf
615	LiBr	Lithium Bromide	libr
616	LiBr^-	lithium bromide anion	libr-
617	LiBr⁺	lithium bromide cation	libr+
618	CuCl	Copper monochloride	cucl
619	NaBr	Sodium Bromide	nabr
620	NaBr^-	sodium bromide anion	nabr-
621	NaBr⁺	sodium bromide cation	nabr+
622	KBr	Potassium Bromide	kbr
623	LiI	Lithium Iodide	lii
624	NaI	Sodium Iodide	nai
625	KI	Potassium Iodide	ki
626	LiF^-	lithium fluoride anion	lif-
627	LiF⁺	lithium fluoride cation	lif+
628	BeF	Beryllium monofluoride	bef
629	BeF^-	Beryllium monofluoride anion	bef-
630	BeF⁺	Beryllium monofluoride cation	bef+
631	BeCl	beryllium monochloride	becl
632	MgF	Magnesium monofluoride	mgf
633	MgF^-	magnesium fluoride anion	mgf-
634	MgF⁺	magnesium fluoride cation	mgf+
635	CaF	Calcium monofluoride	caf
636	MgCl	magnesium monochloride	mgcl
637	MgCl^-	magnesium monochloride anion	mgcl-
638	MgCl⁺	magnesium monochloride cation	mgcl+
639	CaCl	calcium monochloride	cacl
640	TiCl	Titanium Monochloride	ticl
641	ZnF	Zinc monofluoride	znf
642	ZnF^-	Zinc monofluoride anion	znf-
643	ZnF⁺	Zinc monofluoride cation	znf+
644	ZnCl	Zinc monochloride	zncl
645	CaBr	Calcium monobromide	cabr
646	BeCl^-	beryllium monochloride anion	becl-
647	BeCl⁺	beryllium monochloride cation	becl+
648	BF^-	Boron monofluoride anion	bf-
649	BF⁺	Boron monofluoride cation	bf+
650	AlF	Aluminum monofluoride	alf
651	AlF^-	Aluminum monofluoride anion	alf-
652	AlF⁺	Aluminum monofluoride cation	alf+
653	BCl	boron monochloride	bcl
654	BCl^-	boron monochloride anion	bcl-
655	BCl⁺	boron monochloride cation	bcl+
656	AlCl	Aluminum monochloride	alcl
657	AlCl^-	aluminum monochloride anion	alcl-
658	AlCl⁺	aluminum monochloride cation	alcl+
659	ScF	Scandium monofluoride	scf
660	BBr	Boron monobromide	bbr
661	GaF	Gallium monofluoride	gaf
662	GaF⁺	Gallium monofluoride cation	gaf+
663	AlBr	Aluminum monobromide	albr
664	GaCl	Gallium monochloride	gacl
665	GaCl⁺	Gallium monochloride cation	gacl+
666	AlI	Aluminum monoiodide	ali
667	GaBr	Gallium monobromide	gabr
668	CF^-	carbon monofluoride anion	cf-
669	CF⁺	carbon monofluoride cation	cf+
670	CCl	carbon monochloride	ccl
671	CCl^-	carbon monochloride anion	ccl-
672	CCl⁺	carbon monochloride cation	ccl+
673	SiF^-	silicon monofluoride anion	sif-
674	SiCl	Clorosilylidyne	sicl
675	SiCl^-	silicon monochloride anion	sicl-
676	SiCl⁺	silicon monochloride cation	sicl+
677	CBr	Carbon monobromide	cbr
678	GeF	Germanium monofluoride	gef
679	GeF⁺	Germanium monofluoride cation	gef+
680	GeCl	Germanium monochloride	gecl
681	GeCl⁺	Germanium monochloride cation	gecl+
682	SiBr	Silicon monobromide	sibr
683	SiBr⁺	Silicon monobromide cation	sibr+
684	NF	nitrogen fluoride	nf
685	NF^-	nitrogen monofluorine anion	nf-
686	NF⁺	nitrogen monofluoirde cation	nf+
687	NCl^-	nitrogen monochloride anion	ncl-
688	NCl⁺	nitrogen monochloride cation	ncl+
689	PF	phosphorus monofluoride	pf
690	PF^-	phosphorus monofluoride anion	pf-
691	PF⁺	phosphorus monofluoride cation	pf+
692	PCl	phosphorus chloride	pcl
693	PCl^-	phosphorus monochloride anion	pcl-
694	PCl⁺	phosphorus monochloride cation	pcl+
695	AsF	Arsenic monofluoride	asf
696	NBr	nitrogen monobromide	nbr
697	AsCl	Arsenic monochloride	ascl
698	PBr	Phosphorus monobromide	pbr
699	SbF	Antimony monofluoride	sbf
700	SbCl	Antimony monochloride	sbcl
701	FO	Oxygen monofluoride	fo
702	FO^-	flourine oxide anion	fo-
703	FO⁺	fluorine monoxide cation	fo+
704	ClO^-	chlorine monoxide anion	clo-
705	ClO⁺	chlorine monoxide cation	clo+
706	SF^-	sulfur monofluoride anion	sf-
707	SCl^-	sulfur monochloride anion	scl-
708	BrO	Bromine monoxide	bro
709	BrO^-	Bromine monoxide anion	bro-
710	BrO⁺	Bromine monoxide cation	bro+
711	SeF	Selenium monofluoride	sef
712	SBr	Sulfur monobromide radical	sbr
713	SBr⁺	Sulfur monobromide cation	sbr+
714	SeCl	Selenium monochloride	secl
715	IO	Iodine monoxide	io
716	SeBr	Selenium monobromide	sebr
717	BrCl	Bromine monochloride	brcl
718	F₂	Fluorine diatomic	f2
719	F₂^-	flourine diatomic anion	f2-
720	F₂⁺	flourine diatomic cation	f2+
721	ClF^-	clorine monofluoride anion	clf-
722	ClF⁺	clorine monofluoride cation	clf+
723	Cl₂	Chlorine diatomic	cl2
724	Cl₂^-	chlorine diatomic anion	cl2-
725	BrF	Bromine monofluoride	brf
726	BrF^-	bromine fluoride anion	brf-
727	BrF⁺	bromine fluoride cation	brf+
728	BrCl^-	bromine chloride anion	brcl-
729	BrCl⁺	bromine chloride cation	brcl+
730	IF	Iodine monofluoride	if
731	Br₂	Bromine diatomic	br2
732	Br₂^-	bromine diatomic anion	br2-
733	Br₂⁺	bromine diatomic cation	br2+
734	ICl	Iodine monochloride	icl
735	IBr	Iodine monobromide	ibr
736	I₂	Iodine diatomic	i2
737	I₂⁺	Iodine diatomic cation	i2+
738	HCF	Fluoromethylene	hcf
739	HCCl	Chloromethylene	hccl
740	HSiF	fluorosilylene	hsif
741	HSiCl	Chlorosilylene	hsicl
742	HSiBr	monobromosilylene	hsibr
743	CHBr	bromomethylene	chbr
744	HOF	Hypofluorous acid	hfo
745	DOCl	Hypochlorous acid-d	docl
746	HOCl	hypochlorous acid	hocl
747	HOCl⁺	hypochlorous acid cation	hocl+
748	HOBr	Hypobromous acid	hobr
749	HOBr⁺	Hypobromous acid cation	hobr+
750	HOI	Hypoiodous acid	hoi
751	F₂H⁺	Fluorine, protonated	f2h+
752	FHF	Hydrogen difluoride	fhf
753	FHF^-	Hydrogen difluoride anion	fhf-
754	ClFH⁺	Chlorine fluoride, F-protonated	clfh+
755	FClH⁺	Chlorine fluoride, Cl-protonated	fclh+
756	Cl₂H⁺	Chlorine, protonated	cl2h+
757	CH₂Br	bromomethyl radical	ch2br
758	CH₂F	fluoromethyl radical	ch2f
759	CH₂F⁺	fluoromethyl cation	ch2f+
760	CH₂Cl⁺	chloromethyl cation	ch2cl+
761	NH₂F	monofluoroamine	nh2f
762	NH₂Cl	chloramine	nh2cl
763	H₂F₂	Hydrogen fluoride dimer	h2f2
764	CH₃F⁺	methyl fluoride cation	ch3f+
765	CD₃F	methylfluoride-d3	cd3f
766	CD₃Cl	methyl chloride d3	cd3cl
767	CH₃Cl⁺	Methyl chloride cation	ch3cl+
768	SiH₃F	monofluorosilane	sih3f
769	CH₃Br	methyl bromide	ch3br
770	GeH₃F	monofluorogermane	geh3f
771	GeH₃Cl	monochlorogermane	geh3cl
772	SiH₃Br	bromosilane	sih3br
773	CH₃I	methyl iodide	ch3i
774	SiH₃I	Silyl Iodide	sih3i
775	NH₃Cl⁺	protonated monochloroammonia	nh3cl+
776	CH₃ClH⁺	methyl chloride, protonated	ch3clh+
777	NH₄Cl	Ammonium chloride	nh4cl
778	LiNe⁺	Lithium Neon cation	line+
779	Ne₂	Neon diatomic	ne2
780	Ne₂⁺	Neon diatomic cation	ne2+
781	Ar₂	Argon diatomic	ar2
782	Ar₂⁺	Argon diatomic cation	ar2+
783	Li₃	Lithium trimer	li3
784	Li₃⁺	Lithium trimer cation	li3+
785	C₃	carbon trimer	c3
786	C₃⁺	carbon trimer cation	c3+
787	SiC₂	Silicon dicarbide	sic2
788	C₃H₃	cyclopropenyl radical	cpr
789	C₃H₃	Propargyl radical	propargyl
790	C₃H₃^-	Propargyl anion	c3h3-
791	C₃H₃⁺	cyclopropenyl cation	cpr+
792	C₃H₃⁺	Propargyl cation	c3h3+
793	C₃H₄	cyclopropene	cprop
794	CH₂CCH₂	allene	allene
795	CH₃CCH	propyne	propyne
796	C₃H₅	Allyl radical	allyl
797	C₃H₅⁺	Allyl cation	allyl+
798	CH₃CHCH	1-propenyl radical	ch3chch
799	Zn(CH₃)₂	dimethyl zinc	dmz
800	C₃H₆	Cyclopropane	c3h6
801	CH₂CHCH₃	Propene	propene
802	C₃H₇	n-Propyl radical	npropyl
803	C₃H₇⁺	cyclopropane, protonated	c3h7+
804	CH₃CHCH₃	Isopropyl radical	isopropyl
805	CH₃CHCH₃⁺	Isopropyl cation	prop2yl+
806	C₃H₈	Propane	propane
807	SiH₂(CH₃)₂	dimethylsilane	dms
808	KCN	Potassium cyanide	kcn
809	CuCN	Copper cyanide	cucn
810	ZnCN	Zinc monocyanide	zncn
811	ZnNC	Zinc isocyanide	znnc
812	AlCN	Aluminum monocyanide	alcn
813	CN₂	3H-Diazirin-3-ylidene	cn2
814	CNN	Diazocarbene	cnn
815	NCN	Cyanoimidogen	ncn
816	N₃	azide radical	n3
817	N₃^-	azide anion	n3-
818	N₃⁺	azide cation	n3+
819	HCCN	cyanomethylene	hccn
820	HCNN	diazomethyl radical	hcnn
821	HN₃	hydrogen azide	hn3
822	HN₃⁺	Hydrazoic acid cation	hn3+
823	HNCNH	diiminomethane	hncnh
824	CH₂N₂	diazirine	ch2n2
825	CH₂NN	diazomethane	ch2nn
826	NH₂CN	cyanamide	cyanamide
827	HNNNH⁺	1,2-Triazadienium	n2h3+
828	NH₂NN⁺	hydrazoic acid, protonated	nh2nn+
829	CH₃CN	Acetonitrile	ch3cn
830	CH₃CN^-	acetonitrile anion	ch3cn-
831	CH₃CN⁺	Acetonitrile cation	ch3cn+
832	CH₃NC	methyl isocyanide	ch3nc
833	CHNCH₂	2H-Azirine	c157164
834	CHNHCH	1H-Azirine	chnhch
835	H₂CCNH	Ethenimine	ch2cnh
836	H₂CNCH	methyleneaminomethylene	ch2nch
837	HCCNH₂	Ethynamine	hccnh2
838	HCNCH₂⁺	2H-Azirine cation	hcnch2+
839	HNCNH₂⁺	diiminomethane, protonated	hncnh2+
840	NCNH₃⁺	Cyanamide, protonated	ncnh3+
841	NH₂CNH⁺	cyanamide, cn protonated	nh2cnh+
842	NH₃CN⁺	cyanamide, amine protonated	nh3cn+
843	CH₂CHNH	vinylazine	ch2chnh
844	CH₃CHN	methylmethaniminyl radical	ch3chn
845	NHCHNH₂	aminomethanimine	cn2h4
846	C₂H₅N	Aziridine	c2h5n
847	CH₂CHNH₂	aminoethene	aminoethene
848	CH₂NCH₃	N-methylmethanimine	nmm
849	CH₃CHNH	ethanimine	ethanimine
850	NH₂BHNH₂	diaminoborane	nh2bhnh2
851	C₂H₅NH⁺	Protonated Aziridine	c2h5nh+
852	C₂H₆N⁺	aziridine, protonated	c2h6n+
853	NH₂CH₂NH₂	diaminomethane	nh2ch2nh2
854	CH₃CH₂NH₂	Ethylamine	etam
855	CH₃NHCH₃	Dimethylamine	ch3nhch3
856	CH₃PHCH₃	dimethylphosphine	ch3phch3
857	NH₂CH₂NH₃⁺	diaminoethane, protonated	pdam
858	(CH₃)₂NH₂⁺	dimethylammonium cation	dmam
859	CH₃CH₂NH₃⁺	ethylamine, protonated	pea
860	Li₂O	dilithium oxide	li2o
861	Li₂O⁺	dilithium oxide cation	li2o+
862	Na₂S	Sodium sulfide	na2s
863	LiO₂	Lithium dioxide	lio2
864	NaO₂	Sodium superoxide	nao2
865	CNO^-	fulminate	cno-
866	NCO	isocyanato radical	nco
867	NCO^-	cyanate	nco-
868	SCN	thiocyanato radical	scn
869	SCN^-	thiocyanide anion	scn-
870	BO₂	Boron dioxide	bo2
871	BO₂^-	Boron dioxide anion	bo2-
872	BO₂⁺	Boron dioxide cation	bo2+
873	N₂O	Nitrous oxide	n2o
874	N₂O^-	Nitrous oxide anion	n2o-
875	N₂O⁺	Nitrous oxide cation	n2o+
876	NNS	Nitrogen sulfide	nns
877	PPO	Phosphorus oxide phosphide	ppo
878	CO₂^-	Carbon dioxide anion	co2-
879	CO₂⁺	Carbon dioxide cation	co2+
880	OCS	Carbonyl sulfide	cos
881	OCS⁺	Carbonyl sulfide cation	cos+
882	SiO₂	silicon dioxide	sio2
883	CS₂	Carbon disulfide	cs2
884	CS₂^-	Carbon disulfide anion	cs2-
885	CS₂⁺	Carbon disulfide cation	cs2+
886	TiO₂	Titanium dioxide	tio2
887	GeO₂	Germanium dioxide	geo2
888	OCSe	Carbonyl selenide	ocse
889	SCSe	Carbon sulfide selenide	scse
890	GeS₂	Germanium disulfide	ges2
891	CSe₂	Carbon diselenide	cse2
892	SCTe	Carbon sulfide Telluride	scte
893	NO₂	Nitrogen dioxide	no2
894	NO₂^-	Nitrogen dioxide anion	no2-
895	NO₂⁺	Nitrogen dioxide cation	no2+
896	PO₂	Phosphorus dioxide	po2
897	PO₂^-	Phosphorus dioxide anion	po2-
898	PO₂⁺	Phosphorus dioxide cation	po2+
899	AsO₂	Aresenic dioxide	aso2
900	O₃	Ozone	o3
901	O₃^-	Ozone anion	o3-
902	O₃⁺	Ozone cation	o3+
903	SO₂^-	Sulfur dioxide anion	so2-
904	SO₂⁺	Sulfur dioxide cation	so2+
905	SSO	Disulfur monoxide	sso
906	S₃	Sulfur trimer	s3
907	S₃^-	Sulfur trimer anion	s3-
908	SeO₂	Selenium dioxide	seo2
909	SeO₂⁺	Selenium dioxide cation	seo2+
910	TeO₂	Tellurium Dioxide	teo2
911	HCCO	ketenyl radical	ketenyl
912	CS₂H⁺	Carbon disulfide, protonated	cs2h+
913	HCNO	fulminic acid	hcno
914	HNCO	Isocyanic acid	hnco
915	HOCN	cyanic acid	hocn
916	HNCS	Isothiocyanic acid	hncs
917	HSCN	thiocyanic acid	hscn
918	HCO₂^-	formate anion	hco2-
919	HNNO	nitrosoazane	hnno
920	HNNO⁺	Nitrous oxide, N-protonated	hnno+
921	NNOH⁺	Nitrous Oxide, O-protonated	nnoh+
922	HCOO	formate neutral radical	hcoo
923	HOCO	Hydrocarboxyl radical	hoco
924	HOCO⁺	Hydrocarboxyl cation	hoco+
925	HNO₂	Nitrous acid	hno2
926	HNO₂⁺	nitrous acid cation	hno2+
927	O₃H⁺	protonated ozone	o3h+
928	SO₂H⁺	protonated sulfur dioxide	so2h+
929	C₂H₂O	Oxirene	oxirene
930	CH₂CO	Ketene	ch2co
931	CH₂CO⁺	Ketene cation	ch2co+
932	HCCOH	ethynol	hccoh
933	CH₂CS	Thioketene	ch2cs
934	Be(OH)₂	Beryllium hydroxide	beo2h2
935	Mg(OH)₂	Magnesium dihydroxide	h2mgo2
936	NH₂NO	Nitrosamide	nh2no
937	CH₂O₂	Dioxirane	diox
938	H₂COO	Dioxymethyl radical	h2coo
939	H₂COO⁺	dioxymethyl cation	h2coo+
940	HCOOH	Formic acid	ch2o2
941	H₂O₃	Hydrogen trioxide	h2o3
942	HSSSH	trisulfane	hsssh
943	NaOCH₃	Sodium methoxide	naoch3
944	CH₂BOH	hydroxy(methylene)borane	ch2boh
945	CH₃BO	Borane, methyloxo-	ch3bo
946	CH₂CHO	Vinyloxy radical	ch2cho
947	CH₂COH⁺	ketene, protonated	ch2coh+
948	CH₃CO	Acetyl radical	ch3co
949	CH₃CO^-	Acetyl anion	ch3co-
950	CH₃CO⁺	acetyl cation	ch3co+
951	CH₂NOH	formaldoxime	ch2noh
952	CH₃NO	nitrosomethane	ch3no
953	CHONH₂	formamide	formamide
954	CNOH₃	1,2-oxaziridine	cnoh3
955	HOCHNH	hydroxymethylimine	hochnh
956	CHSNH₂	thioformamide	chsnh2
957	NHCHSH	Methanimidothioic acid	nhchsh
958	CH₂OOH	CH2OOH radical	ch2ooh
959	CH₃OO	methylperoxy radical	ch3oo
960	CH₃OO^-	methylperoxy anion	ch3oo-
961	CH₃OO⁺	methylperoxy cation	ch3oo+
962	C₂H₄O	Ethylene oxide	c2h4o
963	C₂H₄O⁺	ethylene oxide cation	c2h4o+
964	CH₂CHOH	ethenol	ch2choh
965	CH₃CHO	Acetaldehyde	ch3cho
966	CH₃CHO⁺	acetaldehyde cation	ch3cho+
967	H₂COCH₂⁺	Methyl, (methyleneoxoniumyl)-	h2coch2+
968	C₂H₄S	Thiirane	thiirane
969	CH₂CHSH	Ethenethiol	ch2chsh
970	CH₃CHS	Thioacetaldehyde	ch3chs
971	H₂CONH₂⁺	protonated formamide	h2conh2+
972	NH₂CHOH⁺	Formamide, O-protonated	nh2choh+
973	NH₃CHO⁺	Formamide, N-Protonated	nh3cho+
974	CH₂(OH)₂	methanediol	ch2o2h2
975	CH₃OOH	Methyl peroxide	ch3ooh
976	HSCH₂SH	Methanedithiol	ch4s2
977	H₂OH₂CO	water formaldehyde dimer	h2oh2co
978	C₂H₄OH⁺	ethylene oxide, protonated	c2h4oh+
979	CH₂CH₂OH	2-hydroxy ethyl radical	ch2ch2oh
980	CH₃CH₂O	Ethoxy radical	ethoxy
981	CH₃CHOH	1-hydroxy-ethyl radical	ch3choh
982	CH₃CHOH⁺	acetaldehyde, protonated	ch3choh+
983	CH₃OCH₂	methoxymethyl radical	ch3och2
984	NH₂CH₂OH	aminomethanol	nh2ch2oh
985	CH₃CH₂OH	Ethanol	etoh
986	CH₃OCH₃	Dimethyl ether	meome
987	CH₃SCH₃	Dimethyl sulfide	mesme
988	CH₃SCH₃⁺	dimethyl sulfide cation	mesme+
989	CH₃SeCH₃	dimethylselenide	dmse
990	CH₃OHH₂O	methanol water dimer	ch3ohh2o
991	H₂OCH₃OH	water methanol dimer	h2och3oh
992	CuF₂	Copper difluoride	cuf2
993	ZnF₂	Zinc difluoride	znf2
994	CNF	iso cyanogen fluoride	cnf
995	FCN	Cyanogen fluoride	fcn
996	ClCN	chlorocyanogen	clcn
997	BrCN	Cyanogen bromide	brcn
998	ICN	Cyanogen iodide	icn
999	FBO	Boron monofluoride monoxide	fbo
1000	BeF₂	Beryllium fluoride	bef2
1001	MgF₂	Magnesium fluoride	mgf2
1002	BeCl₂	Beryllium chloride	becl2
1003	MgCl₂	Magnesium dichloride	mgcl2
1004	CaCl₂	Calcium Chloride	cacl2
1005	ZnCl₂	Zinc dichloride	zncl2
1006	BeBr₂	Beryllium bromide	bebr2
1007	CaBr₂	Calcium dibromide	cabr2
1008	CaF₂	Calcium difluoride	caf2
1009	FCO	Carbonyl fluoride	fco
1010	FCO⁺	Carbonyl fluoride cation	fco+
1011	ClCO	carbonyl monochloride	clco
1012	BF₂	Boron difluoride radical	bf2
1013	FNO	Nitrosyl fluoride	fno
1014	ClNO	Nitrosyl chloride	clno
1015	BrNO	Nitrosyl bromide	brno
1016	INO	Nitrosyl iodide	ino
1017	CF₂^-	Difluoromethylene anion	cf2-
1018	CF₂⁺	Difluoromethylene cation	cf2+
1019	CFCl	chlorofluoromethylene	cfcl
1020	SiF₂	Silicon difluoride	sif2
1021	SiF₂⁺	Silicon difluoride cation	sif2+
1022	CCl₂	dichloromethylene	ccl2
1023	CCl₂^-	dichloromethylene anion	ccl2-
1024	CCl₂⁺	dichloromethylene cation	ccl2+
1025	SiCl₂	Dichlorosilylene	sicl2
1026	GeF₂	Germanium difluoride	gef2
1027	GeCl₂	Germanium dichloride	gecl2
1028	CBr₂	dibromomethylene	cbr2
1029	FOO	Dioxygen monofluoride radical	foo
1030	FOO⁺	Fluorine dioxide cation	foo+
1031	ClOO	chloroperoxy radical	cloo
1032	ClOO⁺	chloroperoxy cation	cloo+
1033	OClO^-	Chlorine dioxide anion	oclo-
1034	OClO⁺	Chlorine dioxide cation	oclo+
1035	ClS₂	Sulfur chloride	cls2
1036	BrOO	Bromine dioxide	broo
1037	OBrO	Bromine dioxide radical	obro
1038	NF₂	Difluoroamino radical	nf2
1039	NF₂⁺	Difluoroamino cation	nf2+
1040	PF₂	Phosphorus difluoride	pf2
1041	PF₂⁺	Phosphorus difluoride cation	pf2+
1042	F₂O	Difluorine monoxide	f2o
1043	SF₂^-	sulfur difluoride anion	sf2-
1044	SF₂⁺	sulfur difluoride cation	sf2+
1045	Cl₂O	Dichlorine monoxide	cl2o
1046	SCl₂	Sulfur dichloride	scl2
1047	SeF₂	Selenium difluoride	sef2
1048	BrOCl	Bromine hypochlorite	brocl
1049	SeCl₂	Selenium Dichloride	secl2
1050	SBr₂	Sulfur dibromide	sbr2
1051	SeBr₂	Selenium dibromide	sebr2
1052	BrOBr	Bromine oxide	brobr
1053	F₃^-	trifluoride anion	f3-
1054	Cl₃^-	trichloride anion	cl3-
1055	Br₃^-	tribromide anion	br3-
1056	I₃^-	triiodide	i3-
1057	SFCl	Sulfur chloride fluoride	sfcl
1058	HCCF⁺	fluoroacetylene cation	hccf+
1059	HCCCl	Chloroacetylene	hcccl
1060	HCCBr	bromoacetylene	hccbr
1061	HFCO	formyl fluoride	hfco
1062	HFCO⁺	formyl fluoride cation	hfco+
1063	COHCl	Formyl chloride	cohcl
1064	COHBr	Formyl bromide	cohbr
1065	BHF₂	Difluoroborane	bhf2
1066	BHCl₂	Borane, dichloro-	bhcl2
1067	CHCl₂	dichloromethyl radical	chcl2
1068	CHF₂	difluoromethyl radical	chf2
1069	CHF₂⁺	difluoromethyl cation	chf2+
1070	CHFCl	Chlorofluoromethyl radical	chfcl
1071	CHFCl⁺	Chlorofluoromethyl cation	chfcl+
1072	CHCl₂⁺	dichloromethyl cation	chcl2+
1073	CHBr₂	dibromomethyl radical	chbr2
1074	HOClO	Chlorous acid	hoclo
1075	NHF₂	difluoramine	nhf2
1076	NHCl₂	dichloroamine	nhcl2
1077	CH₂FCl	fluorochloromethane	ch2fcl
1078	SiH₂F₂	difluorosilane	sih2f2
1079	CH₂BrF	Methane, bromofluoro-	ch2fbr
1080	CH₂BrCl	Methane, bromochloro-	ch2clbr
1081	CH₂FI	fluoroiodomethane	ch2fi
1082	CH₂Br₂	dibromomethane	ch2br2
1083	CH₂ClI	chloroiodomethane	ch2cli
1084	CH₂BrI	bromoiodomethane	ch2bri
1085	CH₂I₂	Diiodomethane	ch2i2
1086	SiH₂Cl₂	dichlorosilane	sih2cl2
1087	CH₃MgBr	Methyl Magnesium Bromide	ch3mgbr
1088	CH₂CHF	Ethene, fluoro-	ch2chf
1089	CH₂CHF⁺	fluoroethene cation	ch2chf+
1090	C₂H₃Cl	Ethene, chloro-	ch2chcl
1091	C₂H₃Br	vinyl bromide	c2h3br
1092	C₂H₃I	Vinyl iodide	c2h3i
1093	CH₂FOH	fluoromethanol	ch2foh
1094	CH₃OCl	methyl hypochlorite	ch3ocl
1095	CH₂CH₂Cl	2-chloroethyl radical	ch2ch2cl
1096	CHClCH₃	1-chloroethyl radical	chclch3
1097	C₂H₅F	fluoroethane	c2h5f
1098	CH₃CH₂Cl	Ethyl chloride	c2h5cl
1099	CH₃SiFH₂	fluoromethylsilane	ch3sifh2
1100	C₂H₅Br	Ethyl bromide	etbr
1101	C₂H₅I	Ethyl iodide	c2h5i
1102	KrF₂	Krypton difluoride	krf2
1103	XeF₂	Xenon difluoride	xef2
1104	B₄H₁₀	Tetraborane(10)	b4h10
1105	C₄	Carbon tetramer	c4
1106	C₄⁺	Carbon tetramer cation	c4+
1107	C₄H₂	Diacetylene	c4h2
1108	C₄H₂⁺	diacetlyene cation	c4h2+
1109	C₂H₃CCH	1-Buten-3-yne	c2h3cch
1110	C₄H₄	cyclobutadiene	cbd
1111	C₄H₄	Tetrahedrane	c4h4
1112	H₂CCCCH₂	Butatriene	h2cccch2
1113	C₄H₆	1-Methylcyclopropene	c3100047
1114	C₄H₆	Cyclobutene	c822355
1115	C₄H₆	Methylenecyclopropane	c6142730
1116	CH₂CCHCH₃	1,2-Butadiene	butad12
1117	CH₂CHCHCH₂	1,3-Butadiene	c106990
1118	CH₃CCCH₃	2-Butyne	c503173
1119	CHCCH₂CH₃	1-Butyne	c107006
1120	CH₃CHCHCH₂	methylallyl radical	c4h7
1121	C₄H₈	methylcyclopropane	mcp
1122	CH₂C(CH₃)CH₃	1-Propene, 2-methyl-	isobute
1123	CH₂CHCH₂CH₃	1-Butene	bute1
1124	CH₃CHCHCH₃	2-Butene, (E)-	bute2e
1125	CH₃CHCHCH₃	2-Butene, (Z)-	bute2z
1126	B(CH₃)₃	trimethylborane	bme3
1127	Al(CH₃)₃	trimethyl aluminum	tma
1128	C(CH₃)₃	Tert-butyl radical	tbutyl
1129	CH₂CH(CH₃)₂	Isobutyl radical	isobutyl
1130	CH₃CHCH₂CH₃	2-Butyl radical	butyl2
1131	CH₃CH(CH₃)CH₃	Isobutane	isobutane
1132	CH₃CH₂CH₂CH₃	Butane	butane
1133	SiH(CH₃)₃	trimethylsilane	trimsi
1134	Li₃N	trilithium nitride	li3n
1135	C₂N₂	Cyanogen	c2n2
1136	C₂N₂⁺	Cyanogen cation	c2n2+
1137	P₄	Phosphorus tetramer	p4
1138	As₄	Arsenic tetramer	as4
1139	HCCCN	Cyanoacetylene	hcccn
1140	HCCCN⁺	Cyanoacetylene cation	hcccn+
1141	H₂CNCN	cyanamide, methylene	ch2ncn
1142	HNCCNH	Ethenediimine	hnccnh
1143	C₃H₃N	acrylonitrile	ch2chcn
1144	C₃H₃N⁺	acrylonitrile cation	ch2chcn+
1145	CH₃N₃	methyl azide	ch3n3
1146	NH₂CCNH₂	Diaminoacetylene	daa
1147	NH₂CH₂CN	Aminoacetonitrile	aan
1148	CH₃NHN₂⁺	methyl azide, protonated	ch3nhn2+
1149	C₂H₅CN	ethyl cyanide	c2h5cn
1150	CH₅N₃	Guanidine	guanidine
1151	C₄H₆	Bicyclo[1.1.0]butane	c157335
1152	CH₃NNCH₃	(Z)-1,2-Dimethyldiazene	dmdiazz
1153	H₂NCHCHNH₂	diaminoethylene	dae
1154	CH₆N₃⁺	guanidinium	ch6n3+
1155	C₃H₇N	Cyclopropylamine	cpram
1156	CH₇N₃	triaminomethane	tam
1157	C₃H₇N	Azetidine	azet
1158	C₄H₈	cyclobutane	cbutane
1159	C₂H₈N₂	Ethylenediamine	ethdiam
1160	CH₃NHNHCH₃	dimethyl hydrazine	dmh
1161	CH₃CH(NH₂)CH₃	2-Propanamine	pram2
1162	N(CH₃)₃	Trimethylamine	trimeam
1163	NH₂CH₂CH₂CH₃	1-Propanamine	pram1
1164	P(CH₃)₃	trimethylphosphine	tmp
1165	N(SiH₃)₃	trisilylamine	tsa
1166	As(CH₃)₃	trimethyl arsine	tmas
1167	(CH₃)₃NH⁺	protonated trimethyl amine	ptma
1168	C₃H₇NH₃⁺	n-propylamine, protonated	c3h7nh2
1169	Li₂O₂	dilithium dioxide	li2o2
1170	Na₂O₂	disodium dioxide	na2o2
1171	K₂O₂	dipotassium dioxide	k2o2
1172	C₃O	Tricarbon monoxide	c3o
1173	B₂O₂	Diboron dioxide	b2o2
1174	ONNO	NO dimer	onno
1175	CO₃	Carbon trioxide	co3
1176	CO₃^--	carbonate	co3--
1177	NO₃	Nitrogen trioxide	no3
1178	NO₃^-	nitrate anion	no3-
1179	NO₃⁺	nitrogen trioxide cation	no3+
1180	SO₃^-	Sulfur trioxide anion	so3-
1181	SO₃^--	Sulfate dianion	so3--
1182	SO₃⁺	Sulfur trioxide cation	so3+
1183	SeO₃	selenium trioxide	seo3
1184	TeO₃	Tellurium trioxide	teo3
1185	HCO₃^-	bicarbonate anion	hco3-
1186	HNO₃	Nitric acid	hno3
1187	HSO₃	Hydroxysulfonyl radical	hso3
1188	NH₂NO₂	nitramide	nh2no2
1189	C₂H₂CO	cyclopropenone	c2h2co
1190	C₃H₂O	Propadienal	c3h2o
1191	HCCCHO	2-propynal	hcccho
1192	C₂H₂O₂	Ethanedial	c2h2o2
1193	C₂H₂O₂⁺	Ethanedial cation	c2h2o2+
1194	H₂CO₃	Carbonic acid	h2co3
1195	H₂CS₃	thiocarbonic acid	h2cs3
1196	H₂NO₃⁺	Nitric Acid, Protonated	h2no3+
1197	H₂SO₃	Sulfurous acid	h2so3
1198	C₂H₃NO	Nitrosoethylene	c2h3no
1199	CH₃NCO	methylisocyante	ch3nco
1200	HOCH₂CN	cyanomethanol	hoch2cn
1201	CH₃COO^-	acetate anion	ch3coo-
1202	CH₃NO₂	Methane, nitro-	ch3no2
1203	CH₃ONO	Methyl nitrite	ch3ono
1204	NH₂COOH	Carbamic acid	nh2cooh
1205	H₃BO₃	Boric acid	h3bo3
1206	H₃CO₃⁺	carbonic acid, protonated	h3co3+
1207	C₃H₄O	2-Propyn-1-ol	c107197
1208	C₃H₄O	allenol	c9000071
1209	C₃H₄O	Cyclopropanone	cpone
1210	C₃H₄O	Methylketene	c6004440
1211	CH₂CHCHO	Acrolein	c3h4o
1212	NH₂CONH₂	Urea	urea
1213	NH₂CONH₂⁺	Urea cation	urea+
1214	NH₂CSNH₂	Thiourea	thiourea
1215	C₂H₄O₂	1,3-dioxetane	c2h4o2
1216	CH₃COOH	Acetic acid	ch3cooh
1217	CH₃OCHO	methyl formate	ch3ocho
1218	CHOCH₂OH	hydroxy acetaldehyde	haa
1219	NH₂COOH₂⁺	Carbamic acid, O-protonated	nh2cooh2+
1220	NH₃COOH⁺	protonated Carbamic acid	nh3cooh+
1221	H₂OHCOOH	Water formic acid dimer 1	h2ohcooh_10
1222	H₂OHCOOH	Water formic acid dimer 2	h2ohcooh_11
1223	HCOOHH₂O	Formic acid water dimer	hcoohh2o
1224	HOCH₂OOH	hydroxy methyl peroxide	hoch2ooh
1225	CH₃COCH₂	Acetonyl radical	ch3coch2
1226	CH₂C(OH)NH₂	1-amino vinyl alchohol	ava
1227	CH₃C(OH)=NH	Ethaninidic acid	eia
1228	CH₃CHNOH	Acetaldoxime	acetaldoxime
1229	CH₃CONH₂	Acetamide	acetamide
1230	HCONHCH₃	N-methylformamide	nmfa
1231	CH₃CSNH₂	Ethanethioamide	ch3csnh2
1232	CH₅N₂O⁺	urea, N-protonated	ch4n2o+
1233	H₂NCOHNH₂⁺	urea, protonated	ureah+
1234	C₂H₅OO	ethylperoxy radical	c2h5oo
1235	CH₃NNCH₃	(E)-1,2-Dimethyldiazene	dmdiaze
1236	C₃H₅OH	Cyclopropanol	cproh
1237	C₃H₆O	2-Propen-1-ol	c107186
1238	C₃H₆O	Acetone enol	enol
1239	C₃H₆O	Oxetane	oxetane
1240	C₃H₆O	Propylene oxide	prox
1241	CH₃CH₂CHO	Propanal	propanal
1242	CH₃COCH₃	Acetone	acetone
1243	CH₃COCH₃^-	acetone anion	ch3coch3-
1244	C₃H₆S	Thietane	thietane
1245	C₃H₆S	Thiirane, methyl-	methiirane
1246	CH₃CSCH₃	Thioacetone	ch3csch3
1247	C₂H₆O₂	1,2-Ethanediol	ethdiol
1248	CH₃OOCH₃	dimethylperoxide	dmp
1249	CH₃SOCH₃	Dimethyl sulfoxide	dmso
1250	CH₂SHCH₂SH	1,2-Ethanedithiol	ethdisl
1251	CH₃SSCH₃	Disulfide, dimethyl	ch3ssch3
1252	CH₃COHCH₃⁺	acetone, protonated	acetoneh+
1253	HOCH₂CH₂NH₂	monoethanolamine	mea
1254	C₃H₇OH	1-Propanol	proh
1255	CH₃CHOHCH₃	Isopropyl alcohol	isoproh
1256	CH₃OC₂H₅	Ethane, methoxy-	etome
1257	C₃H₇SH	1-Propanethiol	prsh
1258	CH₃CHSHCH₃	2-Propanethiol	isoprsh
1259	CH₃SCH₂CH₃	Ethane, (methylthio)-	etsme
1260	H₂OCH₃OCH₃	water dimethylether dimer	h2och3och3
1261	Li₂F₂	Lithium fluoride dimer	li2f2
1262	Na₂F₂	Sodium Fluoride Dimer	na2f2
1263	Na₂Cl₂	Disodium dichloride	na2cl2
1264	C₂F₂	difluoroacetylene	c2f2
1265	C₂Cl₂	dichloroacetylene	c2cl2
1266	C₂Cl₂⁺	dichloroacetylene cation	c2cl2+
1267	FNO₂	Nitryl fluoride	fno2
1268	FONO	Nitrosyl hypofluorite	fono
1269	ClNO₂	Nitryl chloride	clno2
1270	ClONO	chlorine nitrite	clono
1271	BrONO	Bromine nitrite	brono
1272	N₂F₂	(Z)-Difluorodiazene	n2f2_z
1273	N₂F₂	Dinitrogen difluoride, (E)-	n2f2_e
1274	CF₂O⁺	Carbonic difluoride cation	f2co+
1275	COFCl	Carbonic chloride fluoride	cofcl
1276	CCl₂O	Phosgene	cl2co
1277	Cl₂CS	Thiophosgene	cl2cs
1278	COBr₂	Carbonic dibromide	cobr2
1279	BF₃^-	Borane, trifluoro- anion	bf3-
1280	BF₃⁺	boron trifluoride cation	bf3+
1281	BClF₂	Chlorodifluoroborane	bclf2
1282	AlF₂Cl	Aluminum chloride difluoride	alclf2
1283	ScF₃	Scandium trifluoride	ScF3
1284	AlFCl₂	Aluminum dichloride fluoride	alcl2f
1285	BCl₃	Borane, trichloro-	bcl3
1286	BCl₃⁺	Boron Trichloride cation	bcl3+
1287	GaF₃	Gallium trifluoride	gaf3
1288	AlCl₃	Aluminum trichloride	alcl3
1289	GaCl₃	Gallium trichloride	gacl3
1290	BBr₃	Boron tribromide	bbr3
1291	AlBr₃	Aluminum Bromide	albr3
1292	ClO₃	Chlorine trioxide	clo3
1293	ClO₃^-	chlorate anion	clo3-
1294	BrO₃^-	Bromate anion	bro3-
1295	CF₃	Trifluoromethyl radical	cf3
1296	CF₃^-	Trifluoromethyl anion	cf3-
1297	CF₃⁺	Trifluoromethyl cation	cf3+
1298	CF₂Cl	difluorochloromethyl radical	cf2cl
1299	SiF₃	Silicon trifluoride radical	sif3
1300	SiF₃⁺	Silicon trifluoride cation	sif3+
1301	CFCl₂	dichlorofluoromethyl radical	cfcl2
1302	CCl₃	Trichloromethyl radical	ccl3
1303	CCl₃^-	Trichloromethyl anion	ccl3-
1304	CCl₃⁺	Trichloromethyl cation	ccl3+
1305	SiCl₃	trichlorosilyl radical	sicl3
1306	SiCl₃⁺	trichlorosilyl cation	sicl3+
1307	CBr₃	tribromomethyl radical	cbr3
1308	FOOF	Perfluoroperoxide	foof
1309	F₂SO	Thionyl Fluoride	f2so
1310	ClOOCl	Dichlorine dioxide	cloocl
1311	FSSF	Difluorodisulfane	fssf
1312	S₂F₂	Thio-thionyl fluoride	s2f2
1313	SOCl₂	thionyl chloride	socl2
1314	SSCl₂	Thiothionyl chloride	sscl2
1315	SeOCl₂	selenium oxychloride	seocl2
1316	NF₃	Nitrogen trifluoride	nf3
1317	NF₃^-	Nitrogen trifluoride anion	nf3-
1318	NF₃⁺	Nitrogen trifluoride cation	nf3+
1319	PF₃	Phosphorus trifluoride	pf3
1320	NCl₃	nitrogen trichloride	ncl3
1321	AsF₃	Arsenic trifluoride	asf3
1322	PCl₃	Phosphorus trichloride	pcl3
1323	SbF₃	Antimony Trifluoride	sbf3
1324	AsCl₃	Arsenous trichloride	ascl3
1325	SbCl₃	Antimony Trichloride	sbcl3
1326	NBr₃	Nitrogen Tribromide	nbr3
1327	PBr₃	Phosphorus tribromide	pbr3
1328	AsBr₃	Arsenic tribromide	asbr3
1329	NI₃	Nitrogen triiodide	ni3
1330	PI₃	Phosphorus triiodide	pi3
1331	ClSSCl	Disulfur dichloride	s2cl2
1332	BrF₃	Bromine trifluoride	brf3
1333	IF₃	iodone trifluoride	if3
1334	CHF₂Cl	difluorochloromethane	chf2cl
1335	SiHF₃	trifluorosilane	sihf3
1336	CHFCl₂	fluorodichloromethane	chfcl2
1337	CDCl₃	trichloromethane-d	cdcl3
1338	CHCl₃	Chloroform	chcl3
1339	CHBrF₂	Methane, bromodifluoro-	chbrf2
1340	SiHCl₃	Trichlorosilane	sihcl3
1341	CHFClBr	fluorochlorobromomethane	chfclbr
1342	CHBrCl₂	Methane, bromodichloro-	chbrcl2
1343	CHF₂I	difluoroiodomethane	chf2i
1344	CHBr₂F	dibromofluoromethane	chbr2f
1345	CHFClI	fluorochloroiodomethane	chfcli
1346	CHCl₂I	dichloroiodomethane	chcl2i
1347	CHClBr₂	Methane, dibromochloro-	chclbr2
1348	CHBr₃	bromoform	chbr3
1349	CHI₃	Iodoform	chi3
1350	NF₃H⁺	protonated nitrogen trifluoride	nf3h+
1351	AsF₃H⁺	Arsenic trifluoride, protonated	asf3h+
1352	C₂H₂F₂	Ethene, 1,2-difluoro-, (E)-	c2h2f2e
1353	C₂H₂F₂	Ethene, 1,2-difluoro-, (Z)-	c2h2f2z
1354	CH₂CF₂	Ethene, 1,1-difluoro-	ch2cf2
1355	C₂H₂ClF	1-chloro-1-fluoroethylene	c2h2clf
1356	CHFCHCl	(E)-1-chloro-2-fluoroethene	chfchcle
1357	CHFCHClz	(Z)-1-Chloro-2-fluoroethene	chfchclz
1358	CH₂CCl₂	Ethene, 1,1-dichloro-	ch2ccl2
1359	CHClCHCl	Ethene, 1,2-dichloro-, (E)-	chclchcle
1360	CHClCHCl	Ethene, 1,2-dichloro-, (Z)-	chclchclz
1361	C₂H₂Br₂	1,1-dibromoethene	c2h2br2
1362	CHBrCHBr	Ethene, 1,2-dibromo-, (E)-	chbrchbre
1363	CHBrCHBr	Ethene, 1,2-dibromo-, (Z)-	chbrchbrz
1364	CH₂FCHO	Fluoroacetaldehyde	ch2fcho
1365	CH₃COF	Acetyl fluoride	ch3cof
1366	CH₂ClCHO	chloroacetaldehyde	ch2clcho
1367	CH₃COCl	Acetyl Chloride	ch3cocl
1368	C₂H₄F₂	1,2-difluoroethane	c2h4f2
1369	CH₃CHF₂	Ethane, 1,1-difluoro-	ch3chf2
1370	CH₂FCH₂Cl	Ethane, 1-chloro-2-fluoro-	ch2fch2cl
1371	CH₃CHFCl	Ethane, 1-chloro-1-fluoro-	ch3chfcl
1372	CH₂ClCH₂Cl	Ethane, 1,2-dichloro-	ch2clch2cl
1373	CH₃CHCl₂	Ethane, 1,1-dichloro-	ch3chcl2
1374	CH₂BrCH₂Cl	1-bromo-2-chloroethane	ch2brch2cl
1375	CH₂BrCH₂Br	Ethane, 1,2-dibromo-	ch2brch2br
1376	CH₂CFCH₃	2-fluoropropene	2fpro
1377	CH₂CHCH₂F	Allyl Fluoride	allylf
1378	CH₃CHCHF	trans-1-Fluoro-1-propene	propene1ft
1379	C₃H₅Cl	1-Propene, 3-chloro-	prop1cl3
1380	C₃H₅Cl	1-chloro-1-propene(E)	prop1cl1e
1381	C₃H₅Cl	1-chloro-1-propene(Z)	prop1cl1z
1382	CH₂FCH₂OH	2-fluoroethanol	ch2fch2oh
1383	CH₂ClCH₂OH	2-Chloroethanol	ch2clch2oh
1384	CH₂ClCH₂OH₂⁺	2-chloroethanol, protonated	ch2clch2oh2+
1385	CH₂FCH₂CH₃	1-Fluoropropane	prf1
1386	CH₃CHFCH₃	2-Fluoropropane	prf2
1387	CH₂ClCH₂CH₃	Propane, 1-chloro-	prcl1
1388	CH₃CHClCH₃	Propane, 2-chloro-	prcl2
1389	CH₃CH₂CH₂Br	n-propyl bromide	prbr
1390	CH₃CHBrCH₃	i-propyl bromide	iprbr
1391	C₃H₉O⁺	trimethyl oxonium cation	c3h9o+
1392	B₅H₉	pentaborane9	b5h9
1393	C₅H₄	pentatetraene	ptrene
1394	C₅H₅	cyclopentadienyl radical	c5h5
1395	C₅H₅^-	cylopentadienyl anion	c5h5-
1396	C₅H₆	1,3-Cyclopentadiene	c542927
1397	C₅H₆	1-Buten-3-yne, 2-methyl-	c78808
1398	C₅H₆	3-Penten-1-yne, (E)-	c2004695
1399	C₅H₆	3-Penten-1-yne, (Z)-	c1574409
1400	C₅H₆	Bicyclo[2.1.0]pent-2-ene	c5164352
1401	C₅H₆	Cyclopropylacetylene	c6746947
1402	C₅H₆	Propellane	propellane
1403	C₅H₇	1,3-pentadienyl radical	pdyl
1404	C₅H₇	cyclopentenyl radical	cpyl
1405	C₅H₈	1,2-Butadiene, 3-methyl-	c598254
1406	C₅H₈	1,2-Pentadiene	c591957
1407	C₅H₈	1,3-Butadiene, 2-methyl-	c78795
1408	C₅H₈	1,3-Pentadiene, (E)-	c2004708
1409	C₅H₈	1,3-Pentadiene, (Z)-	c1574410
1410	C₅H₈	1,4-Pentadiene	c591935
1411	C₅H₈	1-pentyne	a1pentyne
1412	C₅H₈	2,3-Pentadiene	c591968
1413	C₅H₈	Bicyclo[1.1.1]pentane	bcp
1414	C₅H₈	Cyclobutane, methylene-	c1120565
1415	C₅H₈	Cyclopentene	c142290
1416	C₅H₈	Ethenylcyclopropane	c693867
1417	CH₃CCCH₂CH₃	2-Pentyne	2pentyne
1418	C₅H₁₀	1-Butene, 2-methyl-	c563462
1419	C₅H₁₀	2-Butene, 2-methyl-	c513359
1420	C₅H₁₀	2-Pentene, (E)-	c646048
1421	C₅H₁₀	2-Pentene, (Z)-	c627203
1422	C₅H₁₀	Cyclopentane	c287923
1423	C₅H₁₀	Cyclopropane, 1,1-dimethyl-	c1630940
1424	CH₂CHCH₂CH₂CH₃	1-pentene	pentene
1425	C₅H₁₁	2-Methylbut-2-yl radical	c4348350
1426	C₅H₁₂	Butane, 2-methyl-	buta2
1427	C₅H₁₂	Pentane	pentane
1428	C₅H₁₂	Propane, 2,2-dimethyl-	neopentane
1429	Si(CH₃)₄	tetramethylsilane	tms
1430	N₂O₃	Dinitrogen trioxide	n2o3
1431	C₃H₂N₂	Malononitrile	c3h2n2
1432	CH₂N₄	1H-Tetrazole	1htz
1433	C₃H₃N₂	imidazolyl radical	im
1434	C₃H₃N₂^-	imidizolyl anion	im-
1435	C₂H₃N₃	1H-1,2,4-Triazole	c288880
1436	C₄H₄N	pyrrolide radical	c4h4n
1437	C₄H₄N^-	pyrrolide anion	c4h4n-
1438	C₃H₄N₂	1H-Imidazole	1himidaz
1439	C₃H₄N₂	1H-Pyrazole	1hpyraz
1440	C₃H₄N₂	2H-Imidazole	imid2h
1441	C₃H₄N₂	4H-Imidazole	imid4h
1442	C₄H₅N	(E)-2-Butenenitrile	c627269
1443	C₄H₅N	(Z)-2-Butenenitrile	c1190767
1444	C₄H₅N	2H-pyrrole	pyrrole2
1445	C₄H₅N	3H-pyrrole	pyrrole3
1446	C₄H₅N	Cyclopropanecarbonitrile	c5500210
1447	C₄H₅N	Pyrrole	pyrrole
1448	CH₂CHCH₂CN	Allylcyanide	ch2chch2cn
1449	C₄H₆N⁺	pyrrole, alpha-protonated	appyr
1450	C₄H₆N⁺	pyrrole, beta-protonated	bppyr
1451	C₄H₆N⁺	pyrrole, protonated	ppyr
1452	C₃H₆N₂	3-Aminopropionitrile	c151188
1453	CH₃CH(CH₃)CN	Propanenitrile, 2-methyl-	c4h7n
1454	CH₃CH₂CH₂CN	Butanenitrile	c109740
1455	C₅H₈	Bicyclo[2.1.0]pentane	c185944
1456	C₅H₈	Spiropentane	c157404
1457	C₄H₉N	Cyclobutylamine	cbam
1458	C₄H₉N	Pyrrolidine	pyrrolidine
1459	C₃H₁₀N₂	1,2-Diaminopropane	diampr12
1460	C(CH₃)₃NH₂	2-Propanamine, 2-methyl-	c75649
1461	C(NH₂)H₂C(CH₃)HCH₃	1-Propanamine, 2-methyl-	c78819
1462	C(NH₂)H₂CH₂CH₂CH₃	1-Butanamine	butam1
1463	CH₃C(NH₂)HCH₂CH₃	2-Butanamine	butam2
1464	NH(C₂H₅)₂	diethylamine	dea
1465	NC₄H₁₂⁺	tetramethyl ammonium cation	nc4h12+
1466	C₃O₂	Carbon suboxide	c3o2
1467	C₃O₂⁺	Carbon suboxide cation	c3o2+
1468	B₂O₃	diboron trioxide	b2o3
1469	MgCO₃	Magnesium Carbonate	mgco3
1470	BeCO₃	Beryllium Carbonate	beco3
1471	CaCO₃	Calcium Carbonate	caco3
1472	ONONO	Nitrosyl nitrite	onono
1473	PO₄^---	phosphate	po4---
1474	SO₄^--	sulfate	so4--
1475	HOONO₂	peroxy nitric acid	hoono2
1476	HSO₄^-	bisulfate anion	hso4-
1477	C₂H₂N₂S	1,3,4-Thiadiazole	c2h2n2s
1478	C₃H₂O₂	Propiolic acid	c3h2o2
1479	CHOCOOH	oxo acetic acid	oaa
1480	CHOOCHO	diformyl ether	choocho
1481	H₂SO₄	Sulfuric acid	h2so4
1482	H₂SeO₄	Selenic acid	h2seo4
1483	C₃H₃NO	Isoxazole	isox
1484	C₃H₃NO	Oxazole	oxazole
1485	C₃H₃NS	Thiazole	thiazole
1486	CH₃C(O)OO	acetyl peroxy radical	ch3coo2
1487	CH₃NO₃	Methyl nitrate	ch3no3
1488	H₃PO₄	Phosphoric Acid	h3po4
1489	C₄H₄O	Furan	furan
1490	C₄H₄O⁺	Furan cation	furan+
1491	CH₃COCCH	3-butyn-2-one	c1423605
1492	C₄H₄S	Thiophene	furans
1493	C₄H₄Se	selenophene	c4h4se
1494	C₃H₄O₂	β–Propiolactone	beta
1495	C₃H₄O₂	2-Propenoic acid	propenoic2
1496	C₃H₄O₂	Methyl glyoxal	megly
1497	C₃H₄O₂	propanedial	propanedial
1498	C₃H₄O₂	propenalol	propenalol
1499	HOCHCCHOH	allenediol	aldiol
1500	C₂H₄O₃	1,2,3-trioxolane	c2h4o3
1501	C₂H₄O₃	trioxolane124	triox
1502	HOCH₂COOH	Hydroxyacetic acid	hac
1503	CH₂CHCONH₂	Acrylamide	c79061
1504	CH₃OCH₂CN	Methoxyacetonitrile	c1738369
1505	CH₅N₃S	Hydrazinecarbothioamide	c79196
1506	H₂NCH₂COOH	Glycine	glycine
1507	CH₃SO₂NH₂	methanesulfonamide	ch3so2nh2
1508	C₄H₆O	cis-2-butenal	butenal2c
1509	C₄H₆O	Cyclobutanone	cbutone
1510	C₄H₆O	Furan, 2,3-dihydro-	furan23h
1511	C₄H₆O	Furan, 2,5-dihydro-	furan25h
1512	CH₂CHOCHCH₂	Vinyl ether	vinylether
1513	CHOCHCHCH₃	2-Butenal	butenal2
1514	C₄H₆S	Thiophene, 2,3-dihydro-	thiop23h
1515	C₄H₆S	Thiophene, 2,5-dihydro-	thiop25h
1516	CH₂CHSCHCH₂	Divinyl sulfide	divis
1517	C₂H₆N₂O	Urea, methyl-	c598505
1518	C₃H₆O₂	1,3-Dioxolane	dioxolane
1519	CH₃CH₂COOH	Propanoic Acid	propanoic
1520	CH₃COOCH₃	methyl acetate	aame
1521	HCOOC₂H₅	Ethyl formate	faee
1522	C₂H₆O₂S	Dimethyl sulfone	c67710
1523	CH₃SSSCH₃	dimethyl trisulfide	c2h6s3
1524	C₃H₇NO	dimethylformamide	dmf
1525	C₃H₇NO	Propanamide	propanam
1526	C₂H₃OC₂H₅	Ethene, ethoxy-	c109922
1527	C₄H₈O	Cyclobutanol	c2919235
1528	C₄H₈O	Furan, tetrahydro-	thf
1529	CH₂C(CH₃)OCH₃	1-Propene, 2-methoxy-	pre1meo2
1530	CH₃COCH₂CH₃	2-Butanone	buta2one
1531	CHOCH(CH₃)CH₃	Propanal, 2-methyl-	c78842
1532	CHOCH₂CH₂CH₃	Butanal	butanal
1533	C₄H₈S	Thiophene, tetrahydro-	tht
1534	C₃H₈O₂	1,3-Propanediol	c504632
1535	C₃H₈O₂	Hydroperoxide, 1-methylethyl	c3031752
1536	C₃H₈O₂	Methane, dimethoxy-	c109875
1537	C₃H₈O₂	Propylene glycol	c57556
1538	C₃H₈S₂	1,3-Propanedithiol	c109808
1539	C₄H₁₀O	1-Butanol	butanol1
1540	C₄H₁₀O	1-Propanol, 2-methyl-	c78831
1541	C₄H₁₀O	2-Butanol, (.+/-.)-	butanol2
1542	C₄H₁₀O	Ethanol, 1,1-dimethyl-	tbuoh
1543	C₄H₁₀O	Ethoxy ethane	etoet
1544	C₄H₁₀O	Methyl propyl ether	meopr
1545	C₄H₁₀O	Propane, 2-methoxy-	c598538
1546	C₄H₁₀O⁺	1-Butanol cation	butanol1+
1547	C(CH₃)₃SH	2-Propanethiol, 2-methyl-	tbush
1548	C₂H₅SC₂H₅	Diethyl sulfide	etset
1549	C₄H₉SH	1-Butanethiol	bush
1550	CH₂(SH)CH(CH₃)CH₃	1-Propanethiol, 2-methyl-	c513440
1551	CH₃C(SCH₃)HCH₃	Propane, 2-(methylthio)-	mesipr
1552	CH₃CH(SH)CH₂CH₃	2-Butanethiol	butansl2
1553	FNO₃	Fluorine nitrate	fno3
1554	ClONO₂	Chlorine nitrate	clono2
1555	BrONO₂	Bromine nitrate	brono2
1556	TiCl₄	Titanium tetrachloride	ticl4
1557	ClO₄^-	perchlorate anion	clo4-
1558	BF₄^-	tetrafluoroboron anion	bf4-
1559	ClFO₃	Perchloryl fluoride	clfo3
1560	SO₂F₂	Sulfuryl fluoride	so2f2
1561	SO₂Cl₂	Sulfuryl chloride	so2cl2
1562	F₃NO	Nitrogen trifluoride oxide	f3no
1563	F₃PO	Phosphoryl fluoride	pf3o
1564	Cl₃PO	Phosphoryl chloride	pcl3o
1565	CF₄	Carbon tetrafluoride	cf4
1566	SiF₄	Silicon tetrafluoride	sif4
1567	TiF₄	Titanium tetrafluoride	tif4
1568	CFCl₃	Trichloromonofluoromethane	cfcl3
1569	CF₃Br	Bromotrifluoromethane	cf3br
1570	GeF₄	Germanium tetrafluoride	gef4
1571	CCl₄	Carbon tetrachloride	ccl4
1572	CCl₄⁺	Carbon tetrachloride cation	ccl4+
1573	CBrClF₂	Methane, bromochlorodifluoro-	cbrclf2
1574	SiCl₄	Silane, tetrachloro-	sicl4
1575	CBrCl₂F	bromodichlorofluoromethane	cbrcl2f
1576	CF₃I	trifluoroiodomethane	cf3i
1577	CBrCl₃	Methane, bromotrichloro-	cbrcl3
1578	CBr₂F₂	Methane, dibromodifluoro-	cbr2f2
1579	GeCl₄	Germanium Tetrachloride	gecl4
1580	CBr₂ClF	dibromochlorofluoromethane	cbr2clf
1581	CBr₂Cl₂	dibromodichloromethane	cbr2cl2
1582	CCl₃I	trichloroiodomethane	ccl3i
1583	CFBr₃	fluorotribromomethane	cfbr3
1584	CFClBrI	fluorochlorobromoiodomethane	cfclbri
1585	CBr₃Cl	tribromochloromethane	cbr3cl
1586	CF₂I₂	difluorodiiodomethane	cf2i2
1587	CBr₄	Carbon tetrabromide	cbr4
1588	CCl₂I₂	dichlorodiiodomethane	ccl2i2
1589	SiBr₄	Silicon tetrabromide	sibr4
1590	CBr₃I	tribromoiododmethane	cbr3i
1591	GeBr₄	Germanium tetrabromide	gebr4
1592	CI₄	tetraiodomethane	ci4
1593	SiI₄	silicon tetraiodide	sii4
1594	ClOF₃	Chlorine trifluoride oxide	clof3
1595	SeF₄	Selenium tetrafluoride	sef4
1596	SCl₄	Sulfur tetrachloride	scl4
1597	C₂HF₃	Trifluoroethylene	c2hf3
1598	C₂HF₃⁺	Trifluoroethylene cation	c2hf3+
1599	CHClCCl₂	Trichloroethylene	chclccl2
1600	CHBrCF₂	1-Bromo-2,2-difluoroethylene	chbrcf2
1601	HClO₄	perchloric acid	hclo4
1602	HSO₃F	Fluorosulfonic acid	hso3f
1603	CF₃OH	trifluoromethanol	cf3oh
1604	CH₂ClCCCl	1,3-dichloropropyne	ch2clcccl
1605	CHClCCHCl	1,3-dichloroallene	chclcchcl
1606	CHCl₂CCH	3,3-dichloropropyne	chcl2cch
1607	CHCl₂CHO	dichloroacetaldehyde	chcl2cho
1608	PF₃CH₂	phosphorane, trifluoromethylene-	pf3ch2
1609	CH₃CF₃	Ethane, 1,1,1-trifluoro-	ch3cf3
1610	CHF₂CH₂F	Ethane, 1,1,2-trifluoro	ch2fchf2
1611	CH₃CF₂Cl	1-Chloro-1,1-Difluoroethane	ch3cf2cl
1612	CH₃CFCl₂	1,1-Dichloro-1-fluoroethane	ch3cfcl2
1613	CH₂ClCHCl₂	1,1,2-trichloroethane	ch2clchcl2
1614	CH₃CCl₃	Ethane, 1,1,1-trichloro-	ch3ccl3
1615	SiCl₃CH₃	methyltrichlorosilane	sicl3ch3
1616	CH₃CBr₃	1,1,1-tribromoethane	ch3cbr3
1617	NH₃BCl₃	Amminetrichloroboron	nh3bcl3
1618	SiH₃CCl₃	(trichloromethyl)silane	sih3ccl3
1619	CH₂CClCHCH₂	1,3-Butadiene, 2-chloro-	c4h5cl
1620	C₃H₅ClO	Oxirane, (chloromethyl)-	c106898
1621	CH₂FCH₂CH₂F	1,3-difluoropropane	ch2fch2ch2f
1622	CH₃CF₂CH₃	2,2-difluoropropane	ch3cf2ch3
1623	CH₂ClCH₂CH₂Cl	1,3-dichloropropane	prdicl13
1624	CH₂ClCHClCH₃	Propane, 1,2-dichloro-	prdicl12
1625	CH₃CCl₂CH₃	Propane, 2,2-dichloro-	prdicl22
1626	CHCl₂CH₂CH₃	1,1-dichloropropane	prdicl11
1627	SiCl₂(CH₃)₂	dichlorodimethylsilane	sicl2me2
1628	CH₂CClCH₂CH₃	1-Butene, 2-chloro-	bute1cl2
1629	CH₂CHCH₂CH₂Cl	1-Butene, 4-chloro-	bute1cl4
1630	CH₂CHCHClCH₃	1-Butene, 3-chloro-	bute1cl3
1631	CH₂ClCHCHCH₃	2-Butene, 1-chloro-	bute2cl1
1632	CH₃CClCHCH₃	2-Butene, 2-chloro-, (E)-	bute2cl2e
1633	CH₃CClCHCH₃	2-Butene, 2-chloro-, (Z)-	bute2cl2z
1634	CHClCHCH₂CH₃	(E)-1-Chloro-1-butene	bute1cl1
1635	CHClCHCH₂CH₃	(Z)-1-Chloro-1-butene	bute1cl1z
1636	C₄H₉F	1-fluorobutane	butaf1
1637	CH₃CHFCH₂CH₃	2-fluorobutane	butaf2
1638	CH₂ClCH₂CH₂CH₃	Butane, 1-chloro-	butacl1
1639	CH₃CCl(CH₃)CH₃	Propane, 2-chloro-2-methyl-	procl2me2
1640	CH₃CHClCH₂CH₃	Butane, 2-chloro-	butacl2
1641	XeF₄	Xenon tetrafluoride	xef4
1642	C₂H₂N₂O	Furazan	furazan
1643	CF₃PH₂	phosphine, (trifluoromethyl)-	cf3ph2
1644	NH₃BF₃	Amminetrifluoroboron	nh3bf3
1645	C₆H₂	hexatriyne	c6h2
1646	C₆H₄	(E)-Hexa-1,5-diyne-3-ene	c6h4e
1647	C₆H₄	(Z)-Hexa-1,5-diyne-3-ene	c6h4z
1648	C₆H₄	Benzyne	benzyne
1649	C₆H₅	phenyl	phenyl
1650	C₆H₅^-	phenyl anion	phenyl-
1651	C₆H₆	Prismane	prismane
1652	C₆H₆	1,2,4,5-Hexatetraene	ht1245
1653	C₆H₆	2,4-Hexadiyne	hexadiyne
1654	C₆H₆	3,4-Dimethylenecyclobutene	cb34m
1655	C₆H₆	Benzene	benzene
1656	C₆H₆	Benzvalene	bv
1657	C₆H₆	Dewar Benzene	dewar
1658	C₆H₆	Hexa-1,5-diene-3-yne	hdy153
1659	C₆H₆	Trimethylenecycopropane	tmcp
1660	C₆H₆⁺	Benzene cation	c6h6+
1661	C₆H₇⁺	benzene, protonated	c6h7+
1662	C₆H₈	(E)-hexa-1,3,5-triene	c821078
1663	C₆H₈	(E)-hexa-2,3,4-triene	c59660650
1664	C₆H₈	(Z)-hexa-1,3,5-triene	hexatri135
1665	C₆H₈	(Z)-hexa-2,3,4-triene	hetr234c
1666	C₆H₈	1,3-Cyclohexadiene	cyhexadiene13
1667	C₆H₈	1,4-Cyclohexadiene	cyhexadiene14
1668	C₆H₈	3-Methylenecyclopentene	c930267
1669	C₆H₈	Bicyclo[2.1.1]hex-2-ene	c822413
1670	C₆H₈	Bicyclo[2.2.0]hex-1(4)-ene	c30830207
1671	C₆H₈	Bicyclo[3.1.0]hex-2-ene	c694019
1672	C₆H₁₀	1,3-Hexadiene, (E)-	hexdi13e
1673	C₆H₁₀	1,3-Hexadiene, (Z)-	hexdi13z
1674	C₆H₁₀	1,4-Hexadiene, (E)-	hexdi14t
1675	C₆H₁₀	1,4-Hexadiene, (Z)-	hexdi14z
1676	C₆H₁₀	1,5-Hexadiene	c592427
1677	C₆H₁₀	1-Butyne, 3,3-dimethyl-	c917920
1678	C₆H₁₀	1-Hexyne	hexyne1
1679	C₆H₁₀	2,4-Hexadiene, (E,E)-	hexdi24ee
1680	C₆H₁₀	2,4-Hexadiene, (E,Z)-	hexdi24ez
1681	C₆H₁₀	2,4-Hexadiene, (Z,Z)-	hexdi24zz
1682	C₆H₁₀	2-Hexyne	c764352
1683	C₆H₁₀	3-Hexyne	hexyne3
1684	C₆H₁₀	cyclohexene	cyclohexene
1685	C₆H₁₀	Cyclopentene, 1-methyl-	c693890
1686	C₆H₁₀	Cyclopentene, 3-methyl-	c1120623
1687	C₆H₁₀	Cyclopentene, 4-methyl-	c1759815
1688	C₄H₆(CH₃)₂	1,1-dimethylcyclobutane	dmcb11
1689	C₆H₁₂	(1R,2R)-1,2-dimethylcyclobutane	dmcb12t
1690	C₆H₁₂	(1r,3r)-1,3-dimethylcyclobutane	dmcb13t
1691	C₆H₁₂	(E)-2-Hexene	e2hexene
1692	C₆H₁₂	(E)-3-methylpent-2-ene	c616126
1693	C₆H₁₂	(E)-hex-3-ene	e3hexene
1694	C₆H₁₂	(Z)-3-methylpent-2-ene	c922623
1695	C₆H₁₂	(Z)-hex-2-ene	z2hexene
1696	C₆H₁₂	(Z)-hex-3-ene	z3hexene
1697	C₆H₁₂	2,3-dimethylbut-1-ene	c563780
1698	C₆H₁₂	2,3-dimethyl-but-2-ene	tmeet
1699	C₆H₁₂	3-methylenepentane	c760214
1700	C₆H₁₂	cis-1,2-dimethylcyclobutane	dmcb12c
1701	C₆H₁₂	cis-1,3-dimethylcyclobutane	dmcb13c
1702	C₆H₁₂	Cyclohexane	cyclohexane
1703	C₆H₁₂	Cyclopentane, methyl-	c96377
1704	C₆H₁₂	Ethylcyclobutane	c4806615
1705	C₆H₁₂	hex-1-ene	hexene1
1706	C₆H₁₄	Butane, 2,2-dimethyl-	buta22
1707	C₆H₁₄	Butane, 2,3-dimethyl-	buta23
1708	C₆H₁₄	Hexane	hexane
1709	C₆H₁₄	Pentane, 2-methyl-	penta2
1710	C₆H₁₄	Pentane, 3-methyl-	penta3
1711	C₄N₂	2-Butynedinitrile	c4n2
1712	N₃P₃	1,3,5,2,4,6-Triazatriphosphorine	n3p3
1713	C₄H₂N₂	Fumaronitrile	c4h2n2
1714	C₂H₂N₄	sym-tetrazine	ttz
1715	C₃H₃N₃	1,3,5-Triazine	triazine135
1716	CH₃N₅	5-Aminotetrazole	c4418615
1717	C₄H₄N₂	1,3-Diazine	diazine13
1718	C₄H₄N₂	Pyrazine	pyrazine
1719	C₄H₄N₂	Pyridazine	pyridazine
1720	C₄H₄N₂	Succinonitrile	c110612
1721	C₂H₄N₄	1H-Tetrazole, 1-methyl-	c16681779
1722	C₂H₄N₄	1H-Tetrazole, 5-methyl-	c4076362
1723	C₂H₄N₄	2H-Tetrazole, 2-methyl-	c16681780
1724	C₅H₅N	Bicyclo[1.1.0]butane-1-carbonitrile	bibucn
1725	C₅H₅N	E-2,4-pentadienenitrile	bdcn
1726	C₅H₅N	Pyridine	pyridine
1727	B₃N₃H₆	borazine	borazine
1728	C₆H₆	Fulvene	fulvene
1729	C₅H₆N⁺	Pyridinium	c5h6n
1730	C₄H₆N₂	1H-Imidazole, 2-methyl-	c693981
1731	C₅H₇N	(E)-2-Pentenenitrile	c26294984
1732	C₅H₇N	(E)-3-Pentenenitrile	c16529661
1733	C₅H₇N	(Z)-2-Pentenenitrile	c25899507
1734	C₅H₇N	1H-Pyrrole, 1-methyl-	c96548
1735	C₅H₇N	Cyclobutanecarbonitrile	c4426113
1736	C₅H₉N	1,2,3,6-Tetrahydropyridine	c694053
1737	C₅H₉N	Butanenitrile, 2-methyl-	c18936179
1738	C₅H₉N	Pentanenitrile	c110598
1739	C₅H₉N	Propanenitrile, 2,2-dimethyl-	c630182
1740	C₆H₁₀	Bicyclo[3.1.0]hexane	c285585
1741	C₅H₁₁N	Cyclopentanamine	cypentam
1742	C₅H₁₁N	Piperidine	piper
1743	C₄H₁₂N₂	1,2-Butanediamine	c4426486
1744	C₄H₁₂N₂	2-Methyl-1,2-propanediamine	c811938
1745	Li₂CO₃	Lithium Carbonate	li2co3
1746	Na₂CO₃	Sodium Carbonate	na2co3
1747	C₂O₄^--	oxalate anion	c2o4
1748	MgSO₄	Magnesium Sulfate	mgso4
1749	N₂O₄	Dinitrogen tetroxide	n2o4
1750	C₃H₂O₃	vinylene carbonate	vica
1751	C₂H₂O₄	Oxalic Acid	oxalic
1752	C₂H₃NO₃	Oxamic acid	oxamic
1753	C₄H₄O₂	2(5H)-Furanone	furanone
1754	C₄H₄O₂	2-Oxetanone, 4-methylene-	c674828
1755	C₂H₄N₂O₂	Oxalamide	oxalamide
1756	C₂H₄N₂S₂	Ethanedithioamide	c79403
1757	C₂H₄CO₃	Ethylene carbonate	etco3
1758	C₃H₄O₂S	2H-Thiete-1,1-dioxide	c7285327
1759	C₃H₄S₃	1,3-Dithiolane-2-thione	c822388
1760	C₂H₄O₄	Formic acid dimer	fadimer
1761	C₄H₅NO	3-Methylisoxazole	isox3m
1762	C₄H₅NO	Isoxazole, 5-methyl-	c5765446
1763	C₄H₅NS	4-Methylthiazole	c693958
1764	C₂H₅NO₃	Nitric acid, ethyl ester	c625581
1765	C₅H₆O	2H-Pyran	pyran2
1766	C₅H₆O	2-methylfuran	furan2m
1767	C₅H₆O	3-Methylfuran	furan3m
1768	C₅H₆O	Pentadienal	pdal
1769	C₅H₆S	Thiophene, 2-methyl-	c554143
1770	C₅H₆S	Thiophene, 3-methyl-	c616444
1771	C₄H₆O₂	γ–Butyrolactone	c96480
1772	C₄H₆O₂	2,3-Butanedione	c431038
1773	C₄H₆O₂	2-Propenoic acid, methyl ester	c96333
1774	C₄H₆O₂	Crotonic Acid	crot
1775	C₄H₆OS	2,3-dihydrothiophene-2-ol	c9000117
1776	C₄H₆OS	2,5-dihydrothiophene-3-ol	c9000093
1777	C₄H₆OS	4,5-dihydrothiophene-2-ol	c9000106
1778	C₄H₆OS	4,5-dihydrothiophene-3-ol	c9000082
1779	C₄H₆OS	Dihydro-2-(3H)-thiophenone	c1003107
1780	C₄H₆OS	Dihydro-3-(2H)-thiophenone	c1003049
1781	C₄H₆OS	Vinyl sulfoxide	c1115157
1782	CH₆N₄S	Carbonothioic dihydrazide	thiacarb
1783	C₂H₆N₂O₂	(E)-Azodioxymethane	c37765154
1784	C₂H₆N₂O₂	Dimethylnitroamine	c4164287
1785	C₃H₆O₃	1,3,5-Trioxane	trioxane
1786	C₃H₆S₃	1,3,5-Trithiane	c3h6s3
1787	C₃H₆S₃	Carbonotrithioic acid, dimethyl ester	c2314489
1788	C₂H₆O₃S	Sulfurous acid, dimethyl ester	c616422
1789	C₄H₇NO	2-Pyrrolidinone	c616455
1790	C₄H₇NO	Ethoxyacetonitrile	etoaccn
1791	C₄H₇NO	Methacrylamide	c79390
1792	C₄H₇NO	Oxazole, 4,5-dihydro-2-methyl-	c1120645
1793	HCONH₂CN₂H₄	formamide aminomethanimine dimer	d13
1794	C₃H₇ONO	Propyl nitrite	prono
1795	CH₃CH(CH₃)ONO	Isopropyl nitrite	c541424
1796	CH₃CH(NH₂)COOH	Alanine	alanine
1797	CH₃NHCH₂COOH	Sarcosine	sarcosine
1798	NH₂CH₂CH₂COOH	β–alanine	betaalanine
1799	NH₂COOC₂H₅	Urethane	urethane
1800	C₅H₈O	2H-Pyran, 3,4-dihydro-	c110872
1801	C₅H₈O	Cyclopentanone	c120923
1802	C₅H₈O	Furan, 2,3-dihydro-5-methyl-	c1487156
1803	C₅H₈O	Methyl cyclopropyl ketone	c765435
1804	N(CH₃)₂CONH₂	Urea, N,N-dimethyl-	c598947
1805	NH(CH₃)CONH(CH₃)	Urea, N,N'-dimethyl-	c96311
1806	NH₂CONHC₂H₅	Urea, ethyl-	c625525
1807	C₄H₈O₂	1,3-Dioxane	dioxan13
1808	C₄H₈O₂	1,3-Dioxolane, 2-methyl-	c497267
1809	C₄H₈O₂	1,4-Dioxane	dioxan14
1810	C₄H₈O₂	Ethene, 1,1-dimethoxy-	c922690
1811	C₄H₈O₂	Ethyl acetate	c141786
1812	C₄H₈OS	s-Ethyl thioacetate	c625605
1813	C₃H₈O₃	1,2,3-Propanetriol	glycerin
1814	C₃H₈O₂S	(Methylsulfonyl)ethane	c594434
1815	C₄H₉NO	Butanamide	c541355
1816	C₄H₉NO	Propanamide, 2-methyl-	c563837
1817	C₅H₁₀O	2-Butanone, 3-methyl-	c563804
1818	C₅H₁₀O	2H-Pyran, tetrahydro-	c142687
1819	C₅H₁₀O	2-methylbutyraldehyde	2meba
1820	C₅H₁₀O	2-Pentanone	mpk
1821	C₅H₁₀O	3-Pentanone	dek
1822	C₅H₁₀O	Cyclopentanol	c96413
1823	C₅H₁₀O	Oxetane, 3,3-dimethyl-	c6921353
1824	C₅H₁₀O	Pentanal	pal
1825	C₅H₁₀S	2H-Thiopyran, tetrahydro-	c1613510
1826	C₅H₁₀S	3-Ethylthio-1-propene	c5296628
1827	C₅H₁₀S	Cyclopentanethiol	c1679078
1828	C₅H₁₀S	Thiophene, tetrahydro-2-methyl-	c1795091
1829	C₅H₁₀S	Thiophene, tetrahydro-3-methyl-	c4740005
1830	C₄H₁₀O₂	1,1-Dimethoxyethane	c534156
1831	C₄H₁₀O₂	1,3-Butanediol	budiol13
1832	C₄H₁₀O₂	1,4-Butanediol	budiol14
1833	C₄H₁₀O₂	Ethane, 1,2-dimethoxy-	c110714
1834	C₄H₁₀OS	Diethyl sulfoxide	c70291
1835	C₄H₁₀S₂	1,4-Butanedithiol	budisl14
1836	C₄H₁₁NO	Diethylhydroxylamine	c3710847
1837	C₅H₁₂O	1-Butanol, 2-methyl-	c137326
1838	C₅H₁₂O	1-Butanol, 3-methyl-	c123513
1839	C₅H₁₂O	1-Pentanol	pentanol1
1840	C₅H₁₂O	2-Butanol, 3-methyl-	c598754
1841	C₅H₁₂O	2-Pentanol	peol2
1842	C₅H₁₂O	3-Pentanol	pentan3ol
1843	C₅H₁₂O	Butane, 1-methoxy-	meobu
1844	C₅H₁₂O	Propane, 1-ethoxy-	proet
1845	C₅H₁₂O	Propane, 2-methoxy-2-methyl-	c1634044
1846	C₅H₁₂S	1-Butanethiol, 2-methyl-	c1878188
1847	C₅H₁₂S	1-Butanethiol, 3-methyl-	c541311
1848	C₅H₁₂S	1-Pentanethiol	c110667
1849	C₅H₁₂S	1-Propanethiol, 2,2-dimethyl-	c1679089
1850	C₅H₁₂S	2-Butanethiol, 2-methyl-	c1679090
1851	C₅H₁₂S	2-Butanethiol, 3-methyl-	c2084186
1852	C₅H₁₂S	Butane, 1-(methylthio)-	c628295
1853	C₅H₁₂S	Ethyl propyl sulfide	c4110503
1854	C₅H₁₂S	Propane, 2-(ethylthio)-	c5145993
1855	C₅H₁₂S	Propane, 2-methyl-2-(methylthio)-	c6163640
1856	C₄F₂	difluorobutadiyne	c4f2
1857	ClCOClCO	Oxalyl chloride	oxcl
1858	CF₃CN	Acetonitrile, trifluoro-	cf3cn
1859	CF₃CN⁺	Acetonitrile, trifluoro- cation	cf3cn+
1860	B₂F₄	Diboron tetrafluoride	b2f4
1861	B₂Cl₄	Diboron tetrachloride	b2cl4
1862	C₂F₄	Tetrafluoroethylene	c2f4
1863	C₂F₄⁺	Tetrafluoroethylene cation	c2f4+
1864	C₂ClF₃	Ethene, chlorotrifluoro-	c2f3cl
1865	CF₂CCl₂	difluorodichloroethylene	cf2ccl2
1866	CFClCClF	trans-1,2-dichloro-1,2-difluoroethylene	cfclcclf
1867	CFClCFCl	cis-1,2-dichloro-1,2-difluoroethylene	cfclcfcl
1868	C₂FCl₃	fluorotrichloroethene	c2fcl3
1869	C₂Cl₄	Tetrachloroethylene	c2cl4
1870	C₂Br₄	tetrabromoethene	c2br4
1871	CF₃OF	Trifluoromethylhypofluorite	cf3of
1872	SOF₄	Sulfur tetrafluoride oxide	sof4
1873	AsF₅	Arsenic pentafluoride	asf5
1874	PCl₅	Phosphorus pentachloride	pcl5
1875	SF₅	Sulfur pentafluoride	sf5
1876	SF₅⁺	pentafluoro sulfur cation	sf5+
1877	SbCl₅	Antimony pentachloride	sbcl5
1878	BrF₅	bromine pentafluoride	brf5
1879	ClF₅	chlorinepentafluoride	clf5
1880	IF₅	pentafluoroiodine	if5
1881	CF₃CHO	trifluoroacetaldehyde	cf3cho
1882	CCl₃CHO	trichloroacetaldehyde	ccl3cho
1883	CHFClCHClF	ethane, 1,2-dichloro-1,2-difluoro-	chfclchclf
1884	CF₃CH₂F	1,1,1,2-tetrafluoroethane	cf3ch2f
1885	CHF₂CHF₂	1,1,2,2-tetrafluoroethane	chf2chf2
1886	CF₃CH₂Cl	2,2,2-Trifluoroethyl chloride	cf3ch2cl
1887	CHFClCHFCl	1,2-dichloro-1,2-difluoroethane RR	chfclchfcl
1888	CH₂ClCCl₃	1,1,1,2-tetrachloroethane	ch2clccl3
1889	CHCl₂CHCl₂	Ethane, 1,1,2,2-tetrachloro-	chcl2chcl2
1890	CH₂BrCBr₃	1,1,1,2-tetrabromo ethane	c2h2br4
1891	CHCl₂CHF₂	1,1-dichloro-2,2-difluoroethane	c2h2cl2f2
1892	CF₃COOH	trifluoroacetic acid	cf3cooh
1893	C₄H₃ClO	Furan, 2-chloro	fur2cl
1894	C₄H₃ClO	Furan,3-chloro	fur3cl
1895	C₃H₅ClO₂	Carbonochloridic acid, ethyl ester	c541413
1896	C₃H₅Cl₃	Propane, 1,2,3-trichloro-	prcl135
1897	C₄H₈Cl₂	1,4-Dichlorobutane	c110565
1898	C₄H₈Cl₂	Butane, 1,2-dichloro-	c616217
1899	C₄H₈Cl₂	Butane, 1,3-dichloro-	c1190223
1900	C₄H₈Cl₂	Butane, 2,3-dichloro-, (r,r)-(.+/-.)-	c2211678
1901	C₄H₈Cl₂	Butane, 2,3-dichloro-, (r,s)-	c4028562
1902	C₄H₉ClO	1-Chloro-2-ethoxyethane	c628342
1903	C₅H₁₁Cl	Pentane, 1-chloro-	pencl1
1904	C₄H₈O₂	Butanoic acid	bua
1905	C₆H₅CH₂	benzyl radical	benzyl
1906	C₇H₇	cycloheptatrienyl radical	c7h7
1907	C₇H₇⁺	cycloheptatrienyl cation	c7h7+
1908	C₆H₅CH₃	toluene	toluene
1909	C₇H₈	cycloheptatriene	cht
1910	C₇H₈	Norbornadiene	norbor
1911	C₇H₈	Quadricyclane	qucy
1912	C₇H₁₂	Norbornane	nor
1913	C₇H₁₄	cycloheptane	c7h14
1914	C₇H₁₆	2-methylhexane	2mhex
1915	C₇H₁₆	3-methylhexane	hex3m
1916	C₇H₁₆	heptane	heptane
1917	CH(CN)₃	tricyanomethane	mecn3
1918	HN=C=C(CN)₂	Dicyanoketenimine	c4hn3
1919	C₆H₇N	2-Methylpyridine	mp
1920	C₆H₅NH₂	aniline	aniline
1921	C₆H₁₃N	2-Methylpiperidine	pip2m
1922	C₆H₁₃N	cyclohexanamine	cham
1923	C₆H₁₅N	triethylamine	tea
1924	N₂O₅	Dinitrogen pentoxide	n2o5
1925	C₄H₂O₃	Maleic Anhydride	malan
1926	C₅H₄O₂	4-Cyclopentene-1,3-dione	cpdio
1927	C₅H₄O₂	furfural	furfural
1928	C₆H₅O	phenoxy radical	phenoxy
1929	C₅H₅NO	2(1H)-Pyridinone	c72762006
1930	C₅H₅NO	2(3H)-Pyridinone	c9000048
1931	C₅H₅NO	2(5H)-Pyridinone	c9000037
1932	C₅H₅NO	2-Pyridinol	c109104
1933	C₅H₅NO	3(2H)-Pyridinone	c9000004
1934	C₅H₅NO	3(4H)-Pyridinone	c9000026
1935	C₅H₅NO	3(6H)-Pyridinone	c9000015
1936	C₅H₅NO	3-Pyridinol	c109002
1937	C₅H₅NO	4(1H)-Pryidinone	c9000060
1938	C₅H₅NO	4(3H)-Pryidinone	c9000059
1939	C₅H₅NO	4-Pyridinol	c626642
1940	C₆H₅OH	phenol	phenol
1941	C₆H₆O	2,4-Cyclohexadienone	c24599573
1942	C₆H₆O	2,5-Cyclohexadienone	c5664335
1943	C₆H₅SH	Benzenethiol	phsh
1944	HO₂CCHNH₂CH₂OH	Serine	serine
1945	C₅H₈O₂	Acetylacetone	acac
1946	C₄H₈O₂S	Sulfolane	sulfolane
1947	C₇H₁₀	Norbornene	norbornene
1948	CH(C₂H₃)₃	trivinyl methane	tvm
1949	C₆H₁₀O	cyclohexanone	chexo
1950	C₆H₁₂O	hexanal	c6h12o
1951	C₆H₁₂O	Oxepane	oxepane
1952	C₃H₇OC₃H₇	di-n-propyl ether	propr
1953	F₂CCCF₂	tetrafluoroallene	pfa
1954	CF₃COO^-	trifluoro acetate anion	cf3coo-
1955	CF₃COF	trifluoroacetyl fluoride	cf3cof
1956	CF₃COCl	trifluoroacetyl chloride	cf3cocl
1957	PF₆	Hexafluorophosphate neutral	pf6
1958	PF₆^-	Hexafluorophosphate ion	pf6-
1959	SF₆	Sulfur Hexafluoride	sf6
1960	SeF₆	Selenium hexafluoride	sef6
1961	SF₅Cl	sulfur chloropentafluoride	sf5cl
1962	CF₃CHF₂	pentafluoroethane	cf3chf2
1963	CF₃CHFCl	1,1,1,2-tetrafluorochloroethane	cf3chfcl
1964	CF₃CHCl₂	1,1-Dichloro-2,2,2-trifluoroethane	cf3chcl2
1965	CHCl₂CClF₂	Ethane, 1,2,2-trichloro-1,1-difluoro-	chcl2cclf2
1966	CCl₃CHCl₂	pentachloroethane	ccl3chcl2
1967	C₆H₅F	Fluorobenzene	bzf
1968	C₆H₅Cl	chlorobenzene	bzcl
1969	C₆H₅Br	bromobenzene	bzbr
1970	C₈H₆	Calicene	calicene
1971	C₆H₅CCH	phenylacetylene	phac
1972	C₈H₆	benzocyclobutadiene	bcbd
1973	C₈H₆	Pentalene	pentalene
1974	C₆H₅CHCH₂	Styrene	styrene
1975	C₈H₈	cubane	cubane
1976	C₈H₈	cyclooctatetraene	cot
1977	C₆H₅CH₂CH₃	Ethylbenzene	etbz
1978	CH₃C₆H₄CH₃	meta-xylene	mxylene
1979	CH₃C₆H₄CH₃	paraxylene	pxylene
1980	C₈H₁₄	Bicyclo[2.2.2]octane	bico222
1981	C₈H₁₆	cyclooctane	cyclooct
1982	(CH₃)₃CC(CH₃)₃	tetramethylbutane	tmb
1983	C₈H₁₈	Octane	c8h18
1984	C₆H₅CN	phenyl cyanide	phcn
1985	C₆H₁₂N₂	Triethylenediamine	ted
1986	C₄O₄^--	squarate dianion	c4o4--
1987	S₄N₄	Tetrasulfur tetranitride	s4n4
1988	S₈	Octasulfur	s8
1989	C₆H₄O₂	parabenzoquinone	pbq
1990	C₄H₄N₂O₂	Uracil	uracil
1991	C₆H₅CHO	benzaldehyde	benzal
1992	C₆H₅OCH₃	Anisole	anisole
1993	C₅H₉NO₂	Proline	proline
1994	C₆H₁₂O₂	Methyl pivalate	c598981
1995	C₆H₁₂O₂	Hexanoic acid	hexa
1996	C₄F₄	tetrafluorcyclobutadiene	c4f4
1997	Al₂Cl₆	Aluminum, di-μ-chlorotetrachlorodi-	al2cl6
1998	CF₃CF₂Cl	pentafluorochloroethane	cf3cf2cl
1999	CF₂ClCF₂Cl	1,2-Dichloro-1,1,2,2-tetrafluoroethane	cf2clcf2cl
2000	CF₃CFCl₂	1,1-Dichlorotetrafluoroethane	cf3cfcl2
2001	CF₂ClCFCl₂	Ethane, 1,1,2-trichloro-1,2,2-trifluoro-	cf2clcfcl2
2002	CF₃CCl₃	1,1,1-trifluoro-2,2,2-trichloroethane	cf3ccl3
2003	C₂F₆	hexafluoroethane	c2f6
2004	C₂Cl₆	hexachloroethane	c2cl6
2005	IF₇	Iodine heptafluoride	if7
2006	C₆H₄F₂	metadifluorobenzene	mdfb
2007	C₆H₄F₂	orthodifluorobenzene	odfb
2008	C₆H₄F₂	1,4-difluorobenzene	pdfb
2009	C₆H₄Cl₂	1,2-dichlorobenzene	dcb12
2010	C₆H₄Cl₂	1,3-dichlorobenzene	dcb13
2011	C₆H₄Cl₂	1,4-dichlorobenzene	dcb14
2012	C₆H₅NO	nitrosobenzene	bzno
2013	C₉H₈	Indene	indene
2014	C₉H₈	spiro[4.4]nona-1,3,6,8-tetraene	snt
2015	C₉H₁₂	n-propyl benzene	prbz
2016	C₉H₂₀	Nonane	nonane
2017	C(CN)₄	tetracyanomethane	c5n4
2018	C₅H₄N₄	purine	purine
2019	C₈H₇N	Indole	indole
2020	C₃H₃N₃O₃	cyanuric acid	cyanuric
2021	C₆H₅NO₂	Nitrobenzene	c6h5no2
2022	C₆H₅COOH	benzoic acid	benzo
2023	CH₃COC₆H₅	acetophenone	acph
2024	C₃Cl₃N₃	1,3,5-Triazine, 2,4,6-trichloro-	c3cl3n3
2025	C₃F₆	hexafluoropropene	c3f6
2026	C₆H₃F₃	Benzene trifluoride 123	bzf3a
2027	C₈H₁₈O	1-Octanol	octanol
2028	C₁₀H₈	Azulene	azu
2029	C₁₀H₈	naphthalene	naph
2030	C₁₀H₁₀	bullvalene	bullv
2031	C₁₀H₁₆	adamantane	adamantane
2032	C₆N₄	Tetracyanoethylene	tcne
2033	C₆N₄^-	tetracyanoethylene anion	tcne-
2034	C₁₀H₂₂	Decane	decane
2035	C₄F₆	perfluorobutadiene	c4f6
2036	SF₅CF₃	Sulfur, pentafluoro(trifluoromethyl)-	sf5cf3
2037	C₃F₈	perfluoropropane	c3f8
2038	Fe(CO)₅	Iron pentacarbonyl	ipc
2039	Fe(C₅H₅)₂	ferrocene	fecp2
2040	B₁₂H₁₂^--	Dodecahydrododecaborate(2-)	b12h12--
2041	B₁₂H₁₂^--	Dodecahydrododecaborate(2-)	b12h12--
2042	C₁₂H₈	Acenaphthylene	acenaph
2043	C₁₂H₈	biphenylene	biph
2044	C₁₂H₁₀	biphenyl	biphenyl
2045	C₁₂H₁₀	Heptalene	heptalene
2046	C₆H₁₂O₆	Inositol	inositol
2047	C₆F₆	hexafluorobenzene	c6f6
2048	S₂F₁₀	disulphur decafluoride	s2f10
2049	C₁₃H₁₀	Fluorene	fluorene
2050	C₁₄H₁₀	Anthracene	anth
2051	C₁₄H₁₀	Phenanthrene	phenanthrene
2052	C₁₄H₁₄	Bibenzyl	bibenzyl
2053	C₁₂H₁₀N₂	azobenzene	azobenzene
2054	C₆H₅COC₆H₅	benzophenone	benzophenone
2055	C₁₆H₁₀	Pyrene	pyrene
2056	C₁₈H₁₂	Tetracene	tetracene
2057	C₁₉H₁₆	Triphenylmethane	tpm
2058	C₂₄H₁₂	Coronene	coronene
2059	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