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

List of which calculations are completed at QCISD(T) /6-31G**

count	Species	Name	State	Conformation
1	D	Deuterium atom	¹S	K_h
2	H	Hydrogen atom	¹S	K_h
3	H⁺	Hydrogen atom cation		K_h
4	D₂	Deuterium diatomic	¹Σ_g	D_∞h
5	H₂	Hydrogen diatomic	¹Σ_g	D_∞h
6	H₂^-	hydrogen diatomic anion	²Σ_u⁺	D_∞h
7	HD	Deuterium hydride	¹Σ_g	D_∞h
8	He	Helium atom	¹S	K_h
9	Li	Lithium atom	²S	K_h
10	Na	Sodium atom	²S	K_h
11	K	Potassium atom	²S	K_h
12	Cu	Copper atom	²S	K_h
13	LiH	Lithium Hydride	¹Σ	C_∞v
14	NaH	sodium hydride	¹Σ	C_∞v
15	Be	Beryllium atom	¹S	K_h
16	Be⁺	Beryllium atom cation	²S	K_h
17	Mg	Magnesium atom	¹S	K_h
18	Mg⁺	Magnesium atom cation	²S	K_h
19	Zn	Zinc atom	¹S	K_h
20	BeH	beryllium monohydride	²Σ	C_∞v
21	MgH	magnesium monohydride	²Σ	C_∞v
22	CaH	Calcium monohydride	²Σ	C_∞v
23	BeH₂	beryllium dihydride	¹Σ_g	D_∞h
24	MgH₂	magnesium dihydride	¹Σ_g	D_∞h
25	B	Boron atom	²P	K_h
26	B	Boron atom	⁴P	K_h
27	B⁺	Boron atom cation	¹S	K_h
28	Al	Aluminum atom	²P	K_h
29	Al⁺	Aluminum atom cation	¹S	K_h
30	BH	Boron monohydride	¹Σ	C_∞v
31	AlH	aluminum monohydride	¹Σ	C_∞v
32	BH₂	boron dihydride	²A₁	C_2v
33	AlH₂	aluminum dihydride	²A₁	C_2v
34	BH₃	boron trihydride	¹A₁^'	D_3h
35	AlH₃	aluminum trihydride	¹A₁^'	D_3h
36	C	Carbon atom	³P₀	K_h
37	C	Carbon atom	³P₁	K_h
38	C⁺	Carbon atom cation	²P	K_h
39	Si	Silicon atom	³P	K_h
40	Si	Silicon atom	¹S	K_h
41	Si⁺	Silicon atom cation	²P	K_h
42	CH	Methylidyne	²Π_1/2	C_∞v
43	SiH	Silylidyne	²Π	C_∞v
44	CH₂	Methylene	³B₁	C_2v
45	SiH₂	silicon dihydride	¹A₁	C_2v
46	SiH₂	silicon dihydride	³B₁	C_2v
47	CH₃	Methyl radical	²A₁	D_3h
48	SiH₃	Silyl radical	²A₁	C_3v
49	CH₄	Methane	¹A₁	T_d
50	SiH₄	Silane	¹A₁	T_d
51	N	Nitrogen atom	⁴S	K_h
52	N⁺	Nitrogen atom cation	³P	K_h
53	P	Phosphorus atom	⁴S	K_h
54	NH	Imidogen	³Σ^-	C_∞v
55	PH	phosphorus monohydride	³Σ^-	C_∞v
56	ND₂	Amidogen-d2	²B₁	C_2v
57	NH₂	Amino radical	²B₁	C_2v
58	PH₂	Phosphino radical	²B₁	C_2v
59	AsH₂	Arsenic dihydride	²A₁	C_2v
60	ND₃	Ammonia-d3	¹A₁	C_3v
61	NH₃	Ammonia	¹A₁	C_3v
62	PH₃	Phosphine	¹A₁	C_3v
63	AsH₃	Arsine	¹A₁	C_3v
64	AsH₃⁺	Arsine cation	²A₁	C_3v
65	O	Oxygen atom	³S	K_h
66	O⁺	Oxygen atom cation	⁴S	K_h
67	S	Sulfur atom	³P	K_h
68	DO	Hydroxyl-d	²Π	C_∞v
69	OH	Hydroxyl radical	²Π	C_∞v
70	DS	Mercapto-d	²Π	C_∞v
71	HS	Mercapto radical	²Π	C_∞v
72	D₂O	Deuterium oxide	¹A₁	C_2v
73	H₂O	Water	¹A₁	C_2v
74	HDO	Water-d1	¹A₁	C_2v
75	D₂S	Hydrogen sulfide-d2	¹A₁	C_2v
76	H₂S	Hydrogen sulfide	¹A₁	C_2v
77	F	Fluorine atom	²P	K_h
78	F⁺	Fluorine atom cation	³S	K_h
79	Cl	Chlorine atom	²P	K_h
80	Cl⁺	Chlorine atom cation	³P	K_h
81	Br	Bromine atom	²P	K_h
82	DF	Hydrofluoric acid-d	¹Σ	C_∞v
83	HF	Hydrogen fluoride	¹Σ	C_∞v
84	DCl	Hydrochloric acid-d	¹Σ	C_∞v
85	HCl	Hydrogen chloride	¹Σ	C_∞v
86	Ne	Neon atom	¹S	K_h
87	Ne⁺	Neon atom cation	²P	K_h
88	Ar	Argon atom	¹S	K_h
89	NaLi	lithium sodium	¹Σ	C_∞v
90	Na₂	Sodium diatomic	¹Σ_g	D_∞h
91	C₂H₂	Acetylene	¹Σ_g	D_∞h
92	CuCH₃	monomethyl copper	¹A₁	C_3v
93	C₂H₄	Ethylene	¹A_g	D_2h
94	C₂H₆	Ethane	¹A_1g	D_3d
95	N₂	Nitrogen diatomic	¹Σ_g	D_∞h
96	HCN	Hydrogen cyanide	¹Σ	C_∞v
97	N₂H₂	(E)-diazene	¹A_g	C_2h
98	CO	Carbon monoxide	¹Σ	C_∞v
99	CS	carbon monosulfide	¹Σ	C_∞v
100	NO	Nitric oxide	²Π	C_∞v
101	O₂	Oxygen diatomic	³Σ_g	D_∞h
102	NaOH	sodium hydroxide	¹Σ	C_∞v
103	HCS	Thioformyl radical	²A^'	C_s
104	HO₂	Hydroperoxy radical	²A^"	C_s
105	H₂CO	Formaldehyde	¹A₁	C_2v
106	CuF	Copper monofluoride	¹Σ	C_∞v
107	CuCl	Copper monochloride	¹Σ	C_∞v
108	BF	Boron monofluoride	¹Σ	C_∞v
109	F₂	Fluorine diatomic	¹Σ_g	D_∞h
110	Cl₂	Chlorine diatomic	¹Σ_g	D_∞h
111	HCF	Fluoromethylene	³A^"	C_s
112	NH₂Cl	chloramine	¹A^'	C_s
113	C₃H₅	Allyl radical	²A₂	C_2v
114	C₃H₆	Cyclopropane	¹A₁^'	D_3h
115	CH₂CHCH₃	Propene	¹A^'	C_s
116	CO₂	Carbon dioxide	¹Σ_g	D_∞h
117	SO₂	Sulfur dioxide	¹A₁	C_2v
118	S₃	Sulfur trimer	¹A₁	C_2v
119	HOCO	Hydrocarboxyl radical	¹A^'	cis
120	HOCO	Hydrocarboxyl radical	¹A^'	trans
121	CH₃CO	Acetyl radical	²A^'	C_s
122	As(CH₃)₃	trimethyl arsine	¹A₁	C_3v
123	BF₃	Borane, trifluoro-	¹A^'	D_3h
124	AlF₃	Aluminum trifluoride	¹A₁^'	D_3h

Species NOT done yet

count	Species	Name	file name
1	D^-	Deuterium atom anion	d-
2	D⁺	Deuterium atom cation	d+
3	H^-	Hydrogen atom anion	h-
4	H₂⁺	Hydrogen cation	h2+
5	H₃⁺	hydrogen trimer cation	h3+
6	He^-	Helium atom anion	he-
7	He⁺	Helium atom cation	he+
8	HeH	Helium hydride	heh
9	HeH⁺	Helium hydride cation	heh+
10	He₂⁺	helium diatomic cation	he2+
11	Li^-	Lithium atom anion	li-
12	Li⁺	Lithium atom cation	li+
13	Na^-	Sodium atom anion	na-
14	Na⁺	Sodium atom cation	na+
15	K^-	Potassium atom anion	k-
16	K⁺	Potassium atom cation	k+
17	Cu^-	Copper atom anion	cu-
18	Cu⁺	Copper atom cation	cu+
19	LiH^-	lithium hydride anion	lih-
20	LiH⁺	lithium hydride cation	lih+
21	NaH^-	sodium hydride anion	nah-
22	NaH⁺	sodium hydride cation	nah+
23	KH	Potassium hydride	kh
24	KH⁺	Potassium hydrogen cation	kh+
25	CuH	Copper monohydride	cuh
26	Be^-	Beryllium atom anion	be-
27	Mg^-	Magnesium atom anion	mg-
28	Ca	Calcium atom	ca
29	Ca^-	Calcium atom anion	ca-
30	Ca⁺	Calcium atom cation	ca+
31	Zn^-	Zinc atom anion	zn-
32	Zn⁺	Zinc atom cation	zn+
33	BeH^-	berylium monohydride anion	beh-
34	BeH⁺	beryllium monohydride cation	beh+
35	MgH^-	magnesium monohydride anion	mgh-
36	MgH⁺	magnesium monohydride cation	mgh+
37	CaH⁺	Calcium monohydride cation	cah+
38	TiH	Titanium monohydride	tih
39	ZnH	Zinc monohydride	znh
40	ZnH⁺	Zinc, protonated	znh+
41	BeH₂⁺	Beryllium dihydride cation	beh2+
42	CaH₂	Calcium Hydride	cah2
43	ZnH₂	Zinc hydride	znh2
44	B^-	Boron atom anion	b-
45	Al^-	Aluminum atom anion	al-
46	Sc	Scandium atom	sc
47	Sc⁺	Scandium cation	sc+
48	Ga	Gallium atom	ga
49	Ga^-	Gallium atom anion	ga-
50	Ga⁺	Gallium atom cation	ga+
51	BH^-	boron monohydride anion	bh-
52	BH⁺	boron monohydride cation	bh+
53	AlH^-	aluminum monohydride anion	alh-
54	AlH⁺	aluminum monohydride cation	alh+
55	ScH	Scandium monohydride	sch
56	ScH⁺	Scandium monohydride cation	sch+
57	GaH	Gallium monohydride	gah
58	GaH⁺	Gallium monohydride cation	gah+
59	BH₂^-	boron dihydride anion	bh2-
60	BH₂⁺	Boron dihydride cation	bh2+
61	AlH₂^-	aluminum dihydride anion	alh2-
62	AlH₂⁺	aluminum dihydride cation	alh2+
63	BH₃^-	boron trihydride anion	bh3-
64	BH₃⁺	boron trihydride cation	bh3+
65	AlH₃^-	aluminum trihydride anion	alh3-
66	AlH₃⁺	aluminum trihydride cation	alh3+
67	ScH₃	Scandium trihydride	sch3
68	GaH₃	Gallium trihydride	gah3
69	BH₄	borohydride	bh4
70	BH₄^-	borohydride anion	bh4-
71	AlH₄^-	Aluminum tetrahydride anion	alh4-
72	C^-	Carbon atom anion	c-
73	Si^-	Silicon atom anion	si-
74	Ti	Titanium atom	ti
75	Ti^-	Titanium atom anion	ti-
76	Ti⁺	Titanium atom cation	ti+
77	Ge	Germanium atom	ge
78	Ge^-	Germanium anion	ge-
79	Ge⁺	Germanium cation	ge+
80	Sn	Tin atom	sn
81	Sn⁺	Tin cation	sn+
82	CH^-	methylidyne anion	ch-
83	CH⁺	Methylidyne cation	ch+
84	SiH^-	silicon monohydride anion	sih-
85	SiH⁺	silicon monohydride cation	sih+
86	GeH	germylidene	geh
87	GeH⁺	Germaniun monohyrdide cation	geh+
88	CH₂^-	methylene anion	ch2-
89	CH₂⁺	methylene cation	ch2+
90	SiH₂^-	silicon dihydride anion	sih2-
91	SiH₂⁺	silicon dihydride cation	sih2+
92	GeH₂	germylene	geh2
93	GeH₂^-	germylene anion	geh2-
94	CH₃^-	methyl anion	ch3-
95	CH₃⁺	methyl cation	ch3+
96	SiH₃^-	Silyl anion	sih3-
97	SiH₃⁺	Silyl cation	sih3+
98	GeH₃	Germyl radical	geh3
99	GeH₃⁺	germyl cation	geh3+
100	CD₄	methane-d4	cd4
101	CH₂D₂	methane-d2	ch2d2
102	CH₃D	methane-d	ch3d
103	CH₄^-	Methane anion	ch4-
104	CH₄⁺	Methane cation	ch4+
105	CHD₃	methane-d3	chd3
106	SiH₂D₂	silane-d2	sih2d2
107	SiH₄⁺	Silane cation	sih4+
108	GeH₄	Germane	geh4
109	SnH₄	Stannane	snh4
110	SiH₅⁺	Silane, protonated	sih5+
111	N^-	Nitrogen atom anion	n-
112	P^-	Phosphorus atom anion	p-
113	P⁺	Phosphorus atom cation	p+
114	V	Vanadium atom	v
115	V⁺	Vanadium atom cation	v+
116	As	Arsenic atomic	as
117	As^-	Arsenic anion	as-
118	As⁺	Arsenic cation	as+
119	Sb	Antimony atom	sb
120	NH^-	Imidogen anion	nh-
121	NH⁺	imidogen cation	nh+
122	PH^-	phosphorus monohydride anion	ph-
123	PH⁺	phosphorus monohydride cation	ph+
124	AsH	Arsenic monohydride	ash
125	AsH⁺	Arsenic monohydride cation	ash+
126	SbH	Antimony monohydride	sbh
127	NH₂^-	amino anion	nh2-
128	NH₂⁺	Amino cation	nh2+
129	PH₂^-	Phosphino anion	ph2-
130	PH₂⁺	Phosphino cation	ph2+
131	AsH₂⁺	Arsenic dihydride cation	ash2+
132	NH₃^-	Ammonia anion	nh3-
133	NH₃⁺	ammonia cation	nh3+
134	PH₃⁺	Phosphine cation	ph3+
135	SbH₃	Stibine	sbh3
136	AsH₄⁺	Arsonium	ash4+
137	NH₄	Ammonium radical	nh4
138	NH₄⁺	ammonium cation	nh4+
139	PH₄	Phosphoranyl radical	ph4
140	PH₄⁺	phosphonium cation	ph4+
141	O^-	Oxygen atom anion	o-
142	S^-	Sulfur atom anion	s-
143	S⁺	Sulfur atom cation	s+
144	Cr	Chromium atom	cr
145	Se	Selenium atom	se
146	Se^-	Selenium atom anion	se-
147	Se⁺	Selenium atom cation	se+
148	Te	Tellurium atom	te
149	Te⁺	Tellurium atom cation	te+
150	OH^-	hydroxide anion	oh-
151	OH⁺	hydoxyl cation	oh+
152	HS^-	mercapto anion	sh-
153	HS⁺	sulfur monohydride cation	sh+
154	CrH	Chromium hydride	crh
155	CrH⁺	Chromium hydride cation	crh+
156	HSe	Selenium monohydride	hse
157	HSe^-	selenium monohydride anion	hse-
158	HSe⁺	selenium monohydride cation	hse+
159	TeH	Telluryl radical	teh
160	H₂O^-	water anion	h2o-
161	H₂O⁺	water cation	h2o+
162	H₂S^-	Hydrogen sulfide anion	h2s-
163	H₂S⁺	Hydrogen sulfide cation	h2s+
164	H₂Se	Hydrogen selenide	h2se
165	H₂Se⁺	Hydrogen selenide cation	h2se+
166	H₂Te	Hydrogen Telluride	h2te
167	H₃O⁺	hydronium cation	h3o+
168	H₃S⁺	Sulfonium cation	h3s+
169	H₃Se⁺	Hydrogen Selenide, protonated	h3se+
170	F^-	Fluorine atom anion	f-
171	Cl^-	Chlorine atom anion	cl-
172	Mn	Manganese atom	mn
173	Br^-	Bromine atom anion	br-
174	Br⁺	Bromine atom cation	br+
175	I	Iodine atom	iodine
176	I^-	Iodine atom anion	iodine-
177	I⁺	Iodine atom cation	iodine+
178	HF^-	hydrogen fluoride anion	hf-
179	HF⁺	hydrogen fluoride cation	hf+
180	HCl^-	hydrogen chloride anion	hcl-
181	HCl⁺	hydrogen chloride cation	hcl+
182	HBr	hydrogen bromide	hbr
183	HBr^-	hydrogen bromide anion	hbr-
184	HBr⁺	hydrogen bromide cation	hbr+
185	HI	Hydrogen iodide	hi
186	HI⁺	Hydrogen iodide cation	hi+
187	H₂F⁺	dihydrogen fluoride cation	h2f+
188	H₂Cl⁺	dihydrogen monochloride cation	h2cl+
189	H₂Br⁺	protonated hydrogen bromide	h2br+
190	H₂I⁺	Iodonium	h2i+
191	Ne^-	Neon atom anion	ne-
192	Ar^-	Argon atom anion	ar-
193	Ar⁺	Argon atom cation	ar+
194	Fe	Iron atom	fe
195	Kr	Krypton atom	kr
196	Kr⁺	Krypton cation	kr+
197	Xe	Xenon atom	xe
198	HeLi⁺	Helium Lithium cation	heli+
199	NeH	neon hydrogen	neh
200	NeH⁺	neon hydrogen cation	neh+
201	ArH⁺	Argon hydride cation	arh+
202	KrH⁺	Protonated Krypton	krh+
203	XeH⁺	Xenon, protonated	xeh+
204	H₂Ar	H2 Ar dimer	h2ar
205	Co	Cobalt atom	cobalt
206	Ni	Nickel atom	ni
207	Li₂	Lithium diatomic	li2
208	Li₂^-	lithium diatomic anion	li2-
209	Li₂⁺	lithium diatomic cation	li2+
210	NaLi^-	lithium sodium anion	lina-
211	NaLi⁺	lithium sodium cation	lina+
212	LiK	Lithium Potassium	lik
213	Na₂^-	sodium diatomic anion	na2-
214	Na₂⁺	sodium diatomic cation	na2+
215	NaK	Sodium Potassium	nak
216	NaK⁺	Sodium Potassium diatomic cation	nak+
217	K₂	Potassium diatomic	k2
218	Cu₂	Copper diatomic	cu2
219	LiBe	Lithium Beryllium	libe
220	LiMg	Lithium magnesium	limg
221	NaBe	Sodium Beryllium	nabe
222	NaMg	Sodium Magnesium	namg
223	Be₂	Beryllium diatomic	be2
224	Be₂^-	Beryllium diatomic anion	be2-
225	Be₂⁺	Beryllium diatomic cation	be2+
226	BeMg	Beryllium Magnesium	bemg
227	Mg₂	Magnesium diatomic	mg2
228	Mg₂^-	magnesium diatomic anion	mg2-
229	Mg₂⁺	magnesium diatomic cation	mg2+
230	Ca₂	Calcium diatomic	ca2
231	LiB	Lithium boride	lib
232	LiAl	Lithium Aluminum	lial
233	NaAl	Sodium aluminum	naal
234	BeB	Beryllium monoboride	beb
235	B₂	Boron diatomic	b2
236	B₂^-	Boron diatomic anion	b2-
237	B₂⁺	Boron diatomic cation	b2+
238	BAl	Boron Aluminum	bal
239	Al₂	Aluminum diatomic	al2
240	Al₂^-	aluminum diatomic anion	al2-
241	Al₂⁺	aluminum diatomic cation	al2+
242	BGa	Boron Gallium	bga
243	AlGa	Aluminum Gallium	alga
244	Ga₂	Gallium diatomic	ga2
245	HBBH	Diborane(2)	hbbh
246	LiBH₄	Lithium borohydride	libh4
247	B₂H₄	Diborane(4) D2d	b2h4
248	HBHHBH	Diborane(4) C2V	hbhhbh
249	B₂H₆	Diborane	b2h6
250	B₂H₆⁺	Diborane cation	b2h6
251	Al₂H₆	dialane	al2h6
252	Ga₂H₆	digallane	ga2h6
253	LiC	Lithium Carbide	lic
254	BeC	Beryllium Carbide	bec
255	CaC	Calcium monocarbide	cac
256	BC	boron monocarbide	bc
257	BC^-	boron monocarbide anion	bc-
258	BC⁺	boron monocarbide cation	bc+
259	AlC	Aluminum carbide	alc
260	BSi	Boron silicide	bsi
261	C₂	Carbon diatomic	c2
262	C₂^-	carbon diatomic anion	c2-
263	C₂⁺	carbon diatomic cation	c2+
264	SiC	silicon monocarbide	sic
265	SiC^-	silicon monocarbide anion	sic-
266	SiC⁺	silicon monocarbide cation	sic+
267	Si₂	Silicon diatomic	si2
268	Si₂^-	silcon diatomic anion	si2-
269	Si₂⁺	silcon diatomic cation	si2+
270	GeC	Germanium monocarbide	gec
271	SiGe	Silicon Germanium	sige
272	Ge₂	Germanium diatomic	ge2
273	C₂H	Ethynyl radical	c2h
274	C₂H^-	Ethynyl anion	c2h-
275	C₂H⁺	Ethynyl cation	c2h+
276	ZnCH₂	Zinc methylene	znch2
277	C₂H₂⁺	acetylene cation	c2h2+
278	CCH₂	vinylidene	vinylidene
279	H₂CC^-	vinylidene anion	h2cc-
280	HCCH^-	acetylene anion	c2h2-
281	Si₂H₂	disilyne	si2h2
282	CH₃Li	methyl lithium	ch3li
283	ZnCH₃	Zinc monomethyl	znch3
284	CH₂BH	methyleneborane	ch2bh
285	C₂H₃	vinyl	c2h3
286	C₂H₃^-	vinyl anion	c2h3-
287	C₂H₃⁺	vinyl cation	c2h3+
288	C₂H₄^-	Ethylene anion	c2h4-
289	C₂H₄⁺	Ethylene cation	c2h4+
290	CH₃CH	methylmethylene	ch3ch
291	CH₂SiH₂	silaethylene	ch2sih2
292	Si₂H₄	Disilene	si2h4
293	CH₃BH₂	methylborane	ch3bh2
294	C₂H₅	Ethyl radical	c2h5
295	C₂H₅^-	Ethyl anion	c2h5-
296	C₂H₅⁺	Ethyl cation	c2h5+
297	C₂H₆⁺	ethane cation	c2h6+
298	CH₃SiH₃	methyl silane	ch3sih3
299	Si₂H₆	disilane	si2h6
300	GeH₃CH₃	methyl germane	geh3ch3
301	C₂H₇⁺	Ethane, protonated	c2h7+
302	LiN	Lithium Nitride	lin
303	LiN⁺	Lithium Nitride cation	lin+
304	LiP	Lithium monophosphide	lip
305	BeN	Beryllium mononitride	ben
306	BeN^-	Beryllium mononitride anion	ben-
307	BeN⁺	Beryllium mononitride cation	ben+
308	MgN	Magnesium Nitride	mgn
309	BN^-	boron nitride anion	bn-
310	AlN^-	aluminum mononitride anion	aln-
311	AlN⁺	aluminum mononitride cation	aln+
312	BP	Boron monophosphide	bp
313	AlP	Aluminum monophosphide	alp
314	GaN	Gallium mononitride	gan
315	GaP	Gallium monophosphide	gap
316	GaAs	Gallium arsenide	gaas
317	BN	boron nitride	bn
318	BN⁺	boron nitride cation	bn+
319	AlN	Aluminum nitride	aln
320	CN	Cyano radical	cn
321	CN^-	cyanide anion	cn-
322	CN⁺	Cyano cation	cn+
323	CP	Carbon monophosphide	cp
324	CP^-	carbon monophosphide anion	cp-
325	CP⁺	carbon monophosphide cation	cp+
326	SiN	Silicon nitride	sin
327	SiN^-	silicon mononitride anion	sin-
328	SiN⁺	silicon mononitride cation	sin+
329	SiP	Silicon monophosphide	sip
330	SiP^-	Silicon monophosphide anion	sip-
331	SiP⁺	Silicon monophosphide cation	sip+
332	TiN	Titanium mononitride	tin
333	N₂^-	nitrogen diatomic anion	n2-
334	N₂⁺	diatomic nitrogen cation	n2+
335	PN	Phosphorus mononitride	pn
336	PN^-	phosphorus nitride anion	pn-
337	PN⁺	phosphorus nitride cation	pn+
338	P₂	Phosphorus diatomic	p2
339	P₂^-	phosphorus diatomic anion	p2-
340	P₂⁺	phosphorus diatomic cation	p2+
341	AsN	Arsenic mononitride	asn
342	AsP	Arsenic monophosphide	asp
343	SbN	Antimony nitride	sbn
344	As₂	Arsenic diatomic	as2
345	HNB	hydrogen nitrogen boron	hnb
346	HNC	hydrogen isocyanide	hnc
347	HCN^-	Hydrogen cyanide anion	hcn-
348	HCN⁺	hydrogen cyanide cation	hcn+
349	HNC⁺	hydrogen isocyanide cation	hnc+
350	HCP	Phosphaethyne	hcp
351	HCP⁺	Phosphaethyne cation	hcp+
352	NNH	Dinitrogen monohydride	nnh
353	NNH⁺	Dinitrogen monohydride cation	nnh+
354	HPO	Hydrogen phosphorus oxide	hpo
355	HPO⁺	Hydrogen phosphorus oxide cation	hpo+
356	LiNH₂	lithium amide	linh2
357	HBNH	Boranimine	hbnh
358	CNH₂	Aminomethylidyne radical	cnh2
359	CNH₂⁺	N-protonated hydrogen isocyanide	cnh2+
360	H₂CN	Dihydrogen cyanide radical	h2cn
361	H₂CN⁺	hydrocyanonium cation	h2cn+
362	HCNH	methyleneazane	hcnh
363	HCNH⁺	N-protonated HCN	hcnh+
364	H₂NN	Isodiazene	h2nn
365	N₂H₂	(Z)-Diazene	n2h2z
366	N₂H₂⁺	trans-diazene cation	n2h2+
367	CH₂NH	Methanimine	ch3n
368	CH₂NH⁺	Methanimine cation	ch2nh+
369	CHNH₂	aminomethylene	chnh2
370	CHNH₂⁺	Aminocarbene cation	chnh2+
371	CH₂PH	Phosphaethene	ch3p
372	BH₂NH₂	Boranamine	bh2nh2
373	CH₂NH₂⁺	methyleneamine cation	ch2nh2+
374	N₂H₄	Hydrazine	n2h4
375	N₂H₄⁺	hydrazine cation	n2h4+
376	P₂H₄	Diphosphine	p2h4
377	CH₃NH₂	methyl amine	ch3nh2
378	CH₃NH₂⁺	methyl amine cation	ch3nh2+
379	CH₃PH₂	Methyl phosphine	ch3ph2
380	SiH₃NH₂	Silane, amino	sih3nh2
381	N₂H₅⁺	protonated hydrazine	n2h5+
382	BH₃PH₃	borane phosphine	bh3ph3
383	BH₃NH₃	borane ammonia	bh3nh3
384	CH₃NH₃	methyl ammonium radical	ch3nh3
385	CH₃NH₃⁺	protonated methylamine	ch3nh3+
386	CH₃PH₃⁺	methyl phosphine, protonated	ch3ph3+
387	NH₃NH₃	Ammonia Dimer	nh3nh3
388	N₂H₇⁺	ammonia ammonium dimer	n2h7+
389	LiO	lithium oxide	lio
390	LiO^-	lithium oxide anion	lio-
391	LiO⁺	lithium oxide cation	lio+
392	LiS	Lithium monosulfide	lis
393	LiS⁺	Lithium sulfide cation	lis+
394	NaO	sodium monoxide	nao
395	NaO^-	sodium oxide anion	nao-
396	NaO⁺	sodium oxide cation	nao+
397	KO	Potassium monoxide	ko
398	KO⁺	Potassium monoxide cation	ko+
399	NaS	Sodium sulfide	nas
400	CuO	Copper Monoxide	cuo
401	LiSe	Lithium monoselenide	lise
402	BeO	beryllium oxide	beo
403	BeO^-	Beryllium monoxide anion	beo-
404	BeO⁺	Beryllium monoxide cation	beo+
405	BeS	beryllium sulfide	bes
406	MgO	magnesium oxide	mgo
407	MgO^-	magnesium oxide anion	mgo-
408	MgO⁺	magnesium oxide cation	mgo+
409	CaO	Calcium monoxide	cao
410	MgS	magnesium sulfide	mgs
411	MgS^-	magnesium sulfide anion	mgs-
412	MgS⁺	magnesium sulfide cation	mgs+
413	CaS	Calcium sulfide	cas
414	ZnO	zinc monoxide	zno
415	ZnS	Zinc sulfide	zns
416	BeS^-	Beryllium monosulfide anion	bes-
417	BeS⁺	Beryllium monosulfide cation	bes+
418	BO	boron monoxide	bo
419	BO^-	boron monoxide anion	bo-
420	AlO	Aluminum monoxide	alo
421	AlO^-	Aluminum monoxide anion	alo-
422	AlO⁺	aluminum monoxide cation	alo+
423	BS	boron sulfide	bs
424	BS^-	boron monosulfide anion	bs-
425	BS⁺	boron monosulfide cation	bs+
426	AlS	Aluminum sulfide	als
427	AlS^-	aluminum monosulfide anion	als-
428	AlS⁺	aluminum monosulfide cation	als+
429	ScO	Scandium monoxide	sco
430	GaO	Gallium monoxide	gao
431	GaS	Gallium monosulfide	gas
432	BO⁺	boron monoxide cation	bo+
433	CO^-	carbon monoxide anion	co-
434	CO⁺	carbon monoxide cation	co+
435	CS^-	carbon monosulfide anion	cs-
436	CS⁺	carbon monosulfide cation	cs+
437	SiO	Silicon monoxide	sio
438	SiO^-	silicon monoxide anion	sio-
439	SiO⁺	silicon monoxide cation	sio+
440	SiS	silicon monosulfide	sis
441	SiS^-	silicon monosulfide anion	sis-
442	SiS⁺	silicon monosulfide cation	sis+
443	TiO	Titanium monoxide	tio
444	CSe	Carbon monoselenide	cse
445	CSe^-	Carbon monoselenide anion	cse-
446	CSe⁺	Carbon monoselenide cation	cse+
447	GeO	Germanium monoxide	geo
448	GeO⁺	Germanium monoxide cation	geo+
449	GeS	Germanium monosulfide	ges
450	SiSe	Silicon Monoselenide	sise
451	SiSe⁺	Silicon Monoselenide cation	sise+
452	GeSe	Germanium monoselenide	gese
453	NO^-	nitric oxide anion	no-
454	NO⁺	nitric oxide cation	no+
455	NS	Mononitrogen monosulfide	ns
456	NS^-	nitrogen sulfide anion	ns-
457	NS⁺	nitrogen sulfide cation	ns+
458	PO	Phosphorus monoxide	po
459	PO^-	phosphorus monoxide anion	po-
460	PO⁺	phosphorus monoxide cation	po+
461	PS	phosphorus sulfide	ps
462	PS^-	phosphorus monosulfide anion	ps-
463	PS⁺	phosphorus monosulfide cation	ps+
464	VO	Vanadium monoxide	vo
465	AsO	Arsenic monoxide	aso
466	NSe	Nitrogen monoselenide	nse
467	AsS	Arsenic monosulfide	ass
468	PSe	Phosphorus monoselenide	pse
469	AsSe	Arsenic monoselenide	asse
470	O₂^-	oxygen diatomic anion	o2-
471	O₂^--	dioxygen dianion	o2--
472	O₂⁺	diatomic oxygen cation	o2+
473	SO	Sulfur monoxide	so
474	SO^-	sulfur monoxide anion	so-
475	SO⁺	sulfur monoxide cation	so+
476	S₂	Sulfur diatomic	s2
477	S₂^-	sulfur diatomic anion	s2-
478	S₂⁺	sulfur diatomic cation	s2+
479	SeO	Selenium monoxide	seo
480	SeO^-	selenium monoxide anion	seo-
481	SeO⁺	selenium monoxide cation	seo+
482	SeS	Selenium monosulfide	ses
483	SeS^-	selenium monosulfide anion	ses-
484	SeS⁺	selenium monosulfide cation	ses+
485	TeO	Tellurium monoxide	teo
486	Se₂	Selenium diatomic	se2
487	Se₂^-	selenium diatomic anion	se2-
488	Se₂⁺	selenium diatomic cation	se2+
489	Te₂	Tellurium diatomic	te2
490	LiOH	lithium hydroxide	lioh
491	KOH	Potassium hydroxide	koh
492	BeOH	beryllium monohydroxide	beoh
493	MgOH	magnesium hydroxide	mgoh
494	CaOH	Calcium monohydroxide	caoh
495	HBO	Boron hydride oxide	hbo
496	HBS	hydrogen boron sulfide	hbs
497	COH	Hydroxymethylidyne	coh
498	COH⁺	Carbon Monoxide, protonated	coh+
499	HCO	Formyl radical	hco
500	HCO^-	formyl anion	hco-
501	HCO⁺	Formyl cation	hco+
502	HCS^-	Thioformyl anion	hcs-
503	HCS⁺	Thioformyl cation	hcs+
504	HNO	Nitrosyl hydride	hno
505	HNO^-	Nitrosyl hydride anion	hno-
506	HNO⁺	Nitrosyl hydride cation	hno+
507	NOH	Hydroxyimidogen	noh
508	NOH⁺	O-protonated nitric oxide	noh+
509	HNS	Sulfur imide	hns
510	HNS^-	Sulfur imide anion	hns-
511	HO₂^-	Hydroperoxy anion	ho2-
512	HO₂⁺	Hydroperoxy cation	ho2+
513	HSO⁺	Sulfur Monoxide, S-protonated	HSO+
514	SOH	Sulfur Hydroxide	soh
515	SOH⁺	Sulfur Monoxide, protonated	soh+
516	HS₂	Thiosulfeno radical	hs2
517	H₂CO^-	formaldehyde anion	h2co-
518	H₂CO⁺	formaldehyde cation	h2co+
519	HOCH	hydroxycarbene	hoch
520	H₂CS	Thioformaldehyde	h2cs
521	H₂CS^-	thioformaldehyde anion	h2cs-
522	H₂CS⁺	thioformaldehyde cation	h2cs+
523	H₂CSe	Selenoformaldehyde	h2cse
524	H₂NO	nitroxide	h2no
525	H₂O₂	Hydrogen peroxide	h2o2
526	H₂O₂⁺	Hydrogen peroxide cation	h2o2+
527	H₂OO	water oxide	h2oo
528	HOSH	hydrogen thioperoxide	hosh
529	H₂S₂	Disulfane	h2s2
530	H₂S₂⁺	hydrogen disulfide cation	h2s2+
531	H₂Se₂	hydrogen diselenide	h2se2
532	CH₂OH	Hydroxymethyl radical	ch2oh
533	CH₂OH⁺	hydroxymethyl cation	ch2oh+
534	CH₃O	Methoxy radical	ch3o
535	CH₃O^-	methoxy anion	ch3o-
536	CH₃O⁺	Methoxy cation	ch3o+
537	CH₃S	thiomethoxy	ch3s
538	H₂CSH⁺	Thioformaldehyde, protonated	h2csh+
539	NH₂OH	hydroxylamine	nh2oh
540	NH₂OH⁺	Hydroxylamine cation	nh2oh+
541	NH₃O	Ammonia Oxide	nh3o
542	H₂POH	Phosphinous acid	h2poh
543	H₃PO	Phosphine oxide	h3po
544	NH₂SH	Thiohydroxylamine	nh2sh
545	NH₃S	sulfidoazane	nh3s
546	H₃O₂⁺	hydrogen peroxide, protonated	h3o2+
547	CH₃OH	Methyl alcohol	ch3oh
548	CH₃OH^-	Methyl alcohol anion	ch3oh-
549	CH₃OH⁺	Methyl alcohol cation	ch3oh+
550	CH₃SH	Methanethiol	ch3sh
551	CH₃SH⁺	Methanethiol cation	ch3sh+
552	SiH₃OH	silanol	sih3oh
553	CH₃SeH	Methane selenol	ch3seh
554	NH₂OH₂⁺	protonated hydroxylamine	nh2oh2+
555	NH₃OH⁺	N-protonated hydroxylamine	nh3oh+
556	H₂OH₂O	water dimer	h2oh2o
557	CH₃OH₂⁺	Methanol, protonated	ch3oh2+
558	CH₃SH₂⁺	protonated methylsulfide	ch3sh2+
559	H₂ONH₃	Water Ammonia Dimer	h2onh3
560	H₅O₂⁺	Dihydroxonium ion	h5o2+
561	LiF	lithium fluoride	lif
562	LiCl	lithium chloride	licl
563	LiCl^-	lithium chloride anion	licl-
564	LiCl⁺	lithium chloride cation	licl+
565	NaF	sodium fluoride	naf
566	NaF^-	sodium fluoride anion	naf-
567	NaF⁺	sodium fluoride cation	naf+
568	KF	Potassium Fluoride	kf
569	NaCl	Sodium Chloride	nacl
570	NaCl^-	sodium chloride anion	nacl-
571	NaCl⁺	sodium chloride cation	nacl+
572	KCl	Potassium Chloride	kcl
573	LiBr	Lithium Bromide	libr
574	LiBr^-	lithium bromide anion	libr-
575	LiBr⁺	lithium bromide cation	libr+
576	NaBr	Sodium Bromide	nabr
577	NaBr^-	sodium bromide anion	nabr-
578	NaBr⁺	sodium bromide cation	nabr+
579	KBr	Potassium Bromide	kbr
580	LiI	Lithium Iodide	lii
581	NaI	Sodium Iodide	nai
582	KI	Potassium Iodide	ki
583	LiF^-	lithium fluoride anion	lif-
584	LiF⁺	lithium fluoride cation	lif+
585	BeF	Beryllium monofluoride	bef
586	BeF^-	Beryllium monofluoride anion	bef-
587	BeF⁺	Beryllium monofluoride cation	bef+
588	BeCl	beryllium monochloride	becl
589	MgF	Magnesium monofluoride	mgf
590	MgF^-	magnesium fluoride anion	mgf-
591	MgF⁺	magnesium fluoride cation	mgf+
592	CaF	Calcium monofluoride	caf
593	MgCl	magnesium monochloride	mgcl
594	MgCl^-	magnesium monochloride anion	mgcl-
595	MgCl⁺	magnesium monochloride cation	mgcl+
596	CaCl	calcium monochloride	cacl
597	TiCl	Titanium Monochloride	ticl
598	ZnF	Zinc monofluoride	znf
599	ZnF^-	Zinc monofluoride anion	znf-
600	ZnF⁺	Zinc monofluoride cation	znf+
601	ZnCl	Zinc monochloride	zncl
602	CaBr	Calcium monobromide	cabr
603	BeCl^-	beryllium monochloride anion	becl-
604	BeCl⁺	beryllium monochloride cation	becl+
605	BF^-	Boron monofluoride anion	bf-
606	BF⁺	Boron monofluoride cation	bf+
607	AlF	Aluminum monofluoride	alf
608	AlF^-	Aluminum monofluoride anion	alf-
609	AlF⁺	Aluminum monofluoride cation	alf+
610	BCl	boron monochloride	bcl
611	BCl^-	boron monochloride anion	bcl-
612	BCl⁺	boron monochloride cation	bcl+
613	AlCl	Aluminum monochloride	alcl
614	AlCl^-	aluminum monochloride anion	alcl-
615	AlCl⁺	aluminum monochloride cation	alcl+
616	ScF	Scandium monofluoride	scf
617	BBr	Boron monobromide	bbr
618	GaF	Gallium monofluoride	gaf
619	GaF⁺	Gallium monofluoride cation	gaf+
620	AlBr	Aluminum monobromide	albr
621	GaCl	Gallium monochloride	gacl
622	GaCl⁺	Gallium monochloride cation	gacl+
623	AlI	Aluminum monoiodide	ali
624	GaBr	Gallium monobromide	gabr
625	CF	Fluoromethylidyne	cf
626	CF^-	carbon monofluoride anion	cf-
627	CF⁺	carbon monofluoride cation	cf+
628	CCl	carbon monochloride	ccl
629	CCl^-	carbon monochloride anion	ccl-
630	CCl⁺	carbon monochloride cation	ccl+
631	SiF	silicon monofluoride	sif
632	SiF^-	silicon monofluoride anion	sif-
633	SiF⁺	silicon monofluoride cation	sif+
634	SiCl	Clorosilylidyne	sicl
635	SiCl^-	silicon monochloride anion	sicl-
636	SiCl⁺	silicon monochloride cation	sicl+
637	CBr	Carbon monobromide	cbr
638	GeF	Germanium monofluoride	gef
639	GeF⁺	Germanium monofluoride cation	gef+
640	GeCl	Germanium monochloride	gecl
641	GeCl⁺	Germanium monochloride cation	gecl+
642	SiBr	Silicon monobromide	sibr
643	SiBr⁺	Silicon monobromide cation	sibr+
644	NF	nitrogen fluoride	nf
645	NF^-	nitrogen monofluorine anion	nf-
646	NF⁺	nitrogen monofluoirde cation	nf+
647	NCl	nitrogen monochloride	ncl
648	NCl^-	nitrogen monochloride anion	ncl-
649	NCl⁺	nitrogen monochloride cation	ncl+
650	PF	phosphorus monofluoride	pf
651	PF^-	phosphorus monofluoride anion	pf-
652	PF⁺	phosphorus monofluoride cation	pf+
653	PCl	phosphorus chloride	pcl
654	PCl^-	phosphorus monochloride anion	pcl-
655	PCl⁺	phosphorus monochloride cation	pcl+
656	AsF	Arsenic monofluoride	asf
657	NBr	nitrogen monobromide	nbr
658	AsCl	Arsenic monochloride	ascl
659	PBr	Phosphorus monobromide	pbr
660	SbF	Antimony monofluoride	sbf
661	SbCl	Antimony monochloride	sbcl
662	FO	Oxygen monofluoride	fo
663	FO^-	flourine oxide anion	fo-
664	FO⁺	fluorine monoxide cation	fo+
665	ClO	Monochlorine monoxide	clo
666	ClO^-	chlorine monoxide anion	clo-
667	ClO⁺	chlorine monoxide cation	clo+
668	SF	Monosulfur monofluoride	sf
669	SF^-	sulfur monofluoride anion	sf-
670	SF⁺	sulfur monofluoride cation	sf+
671	SCl	sulfur monochloride	scl
672	SCl^-	sulfur monochloride anion	scl-
673	SCl⁺	sulfur monochloride cation	scl+
674	BrO	Bromine monoxide	bro
675	BrO^-	Bromine monoxide anion	bro-
676	BrO⁺	Bromine monoxide cation	bro+
677	SeF	Selenium monofluoride	sef
678	SBr	Sulfur monobromide radical	sbr
679	SBr⁺	Sulfur monobromide cation	sbr+
680	SeCl	Selenium monochloride	secl
681	IO	Iodine monoxide	io
682	SeBr	Selenium monobromide	sebr
683	BrCl	Bromine monochloride	brcl
684	F₂^-	flourine diatomic anion	f2-
685	F₂⁺	flourine diatomic cation	f2+
686	ClF	Chlorine monofluoride	clf
687	ClF^-	clorine monofluoride anion	clf-
688	ClF⁺	clorine monofluoride cation	clf+
689	Cl₂^-	chlorine diatomic anion	cl2-
690	Cl₂⁺	chlorine diatomic cation	cl2+
691	BrF	Bromine monofluoride	brf
692	BrF^-	bromine fluoride anion	brf-
693	BrF⁺	bromine fluoride cation	brf+
694	BrCl^-	bromine chloride anion	brcl-
695	BrCl⁺	bromine chloride cation	brcl+
696	IF	Iodine monofluoride	if
697	Br₂	Bromine diatomic	br2
698	Br₂^-	bromine diatomic anion	br2-
699	Br₂⁺	bromine diatomic cation	br2+
700	ICl	Iodine monochloride	icl
701	IBr	Iodine monobromide	ibr
702	I₂	Iodine diatomic	i2
703	I₂⁺	Iodine diatomic cation	i2+
704	HCF	Fluoromethylene	hcf
705	HCCl	Chloromethylene	hccl
706	HSiF	fluorosilylene	hsif
707	HSiCl	Chlorosilylene	hsicl
708	HSiBr	monobromosilylene	hsibr
709	CHBr	bromomethylene	chbr
710	HOF	Hypofluorous acid	hfo
711	DOCl	Hypochlorous acid-d	docl
712	HOCl	hypochlorous acid	hocl
713	HOCl⁺	hypochlorous acid cation	hocl+
714	HOBr	Hypobromous acid	hobr
715	HOBr⁺	Hypobromous acid cation	hobr+
716	HOI	Hypoiodous acid	hoi
717	F₂H⁺	Fluorine, protonated	f2h+
718	FHF	Hydrogen difluoride	fhf
719	FHF^-	Hydrogen difluoride anion	fhf-
720	ClFH⁺	Chlorine fluoride, F-protonated	clfh+
721	FClH⁺	Chlorine fluoride, Cl-protonated	fclh+
722	Cl₂H⁺	Chlorine, protonated	cl2h+
723	CH₂Br	bromomethyl radical	ch2br
724	CH₂F	fluoromethyl radical	ch2f
725	CH₂F⁺	fluoromethyl cation	ch2f+
726	CH₂Cl⁺	chloromethyl cation	ch2cl+
727	CH₂Cl	chloromethyl radical	ch2cl
728	NH₂F	monofluoroamine	nh2f
729	H₂F₂	Hydrogen fluoride dimer	h2f2
730	CH₃F⁺	methyl fluoride cation	ch3f+
731	CD₃F	methylfluoride-d3	cd3f
732	CH₃F	Methyl fluoride	ch3f
733	CD₃Cl	methyl chloride d3	cd3cl
734	CH₃Cl	Methyl chloride	ch3cl
735	CH₃Cl⁺	Methyl chloride cation	ch3cl+
736	SiH₃F	monofluorosilane	sih3f
737	SiH₃Cl	chlorosilane	sih3cl
738	CH₃Br	methyl bromide	ch3br
739	GeH₃F	monofluorogermane	geh3f
740	GeH₃Cl	monochlorogermane	geh3cl
741	SiH₃Br	bromosilane	sih3br
742	CH₃I	methyl iodide	ch3i
743	SiH₃I	Silyl Iodide	sih3i
744	NH₃Cl⁺	protonated monochloroammonia	nh3cl+
745	CH₃ClH⁺	methyl chloride, protonated	ch3clh+
746	NH₄Cl	Ammonium chloride	nh4cl
747	LiNe⁺	Lithium Neon cation	line+
748	Ne₂	Neon diatomic	ne2
749	Ne₂⁺	Neon diatomic cation	ne2+
750	Ar₂	Argon diatomic	ar2
751	Ar₂⁺	Argon diatomic cation	ar2+
752	Li₃	Lithium trimer	li3
753	Li₃⁺	Lithium trimer cation	li3+
754	C₃	carbon trimer	c3
755	C₃⁺	carbon trimer cation	c3+
756	SiC₂	Silicon dicarbide	sic2
757	C₃H₃	cyclopropenyl radical	cpr
758	C₃H₃	Propargyl radical	propargyl
759	C₃H₃^-	Propargyl anion	c3h3-
760	C₃H₃⁺	cyclopropenyl cation	cpr+
761	C₃H₃⁺	Propargyl cation	c3h3+
762	C₃H₄	cyclopropene	cprop
763	CH₂CCH₂	allene	allene
764	CH₃CCH	propyne	propyne
765	C₃H₅⁺	Allyl cation	allyl+
766	CH₃CHCH	1-propenyl radical	ch3chch
767	Zn(CH₃)₂	dimethyl zinc	dmz
768	C₃H₇	n-Propyl radical	npropyl
769	C₃H₇⁺	cyclopropane, protonated	c3h7+
770	CH₃CHCH₃	Isopropyl radical	isopropyl
771	CH₃CHCH₃⁺	Isopropyl cation	prop2yl+
772	C₃H₈	Propane	propane
773	SiH₂(CH₃)₂	dimethylsilane	dms
774	Si₃H₈	trisilane	si3h8
775	LiCN	lithium cyanide	licn
776	NaCN	Sodium Cyanide	nacn
777	KCN	Potassium cyanide	kcn
778	CuCN	Copper cyanide	cucn
779	ZnCN	Zinc monocyanide	zncn
780	ZnNC	Zinc isocyanide	znnc
781	AlCN	Aluminum monocyanide	alcn
782	AlNC	Aluminum isocyanide	alnc
783	CN₂	3H-Diazirin-3-ylidene	cn2
784	CNN	Diazocarbene	cnn
785	NCN	Cyanoimidogen	ncn
786	N₃	azide radical	n3
787	N₃^-	azide anion	n3-
788	N₃⁺	azide cation	n3+
789	HCCN	cyanomethylene	hccn
790	HCNN	diazomethyl radical	hcnn
791	HN₃	hydrogen azide	hn3
792	HN₃⁺	Hydrazoic acid cation	hn3+
793	HNCNH	diiminomethane	hncnh
794	CH₂N₂	diazirine	ch2n2
795	CH₂NN	diazomethane	ch2nn
796	NH₂CN	cyanamide	cyanamide
797	HNNNH⁺	1,2-Triazadienium	n2h3+
798	NH₂NN⁺	hydrazoic acid, protonated	nh2nn+
799	CH₃CN	Acetonitrile	ch3cn
800	CH₃CN^-	acetonitrile anion	ch3cn-
801	CH₃CN⁺	Acetonitrile cation	ch3cn+
802	CH₃NC	methyl isocyanide	ch3nc
803	CHNCH₂	2H-Azirine	c157164
804	CHNHCH	1H-Azirine	chnhch
805	H₂CCNH	Ethenimine	ch2cnh
806	H₂CNCH	methyleneaminomethylene	ch2nch
807	HCCNH₂	Ethynamine	hccnh2
808	HCNCH₂⁺	2H-Azirine cation	hcnch2+
809	HNCNH₂⁺	diiminomethane, protonated	hncnh2+
810	NCNH₃⁺	Cyanamide, protonated	ncnh3+
811	NH₂CNH⁺	cyanamide, cn protonated	nh2cnh+
812	NH₃CN⁺	cyanamide, amine protonated	nh3cn+
813	CH₂CHNH	vinylazine	ch2chnh
814	CH₃CHN	methylmethaniminyl radical	ch3chn
815	NHCHNH₂	aminomethanimine	cn2h4
816	C₂H₅N	Aziridine	c2h5n
817	CH₂CHNH₂	aminoethene	aminoethene
818	CH₂NCH₃	N-methylmethanimine	nmm
819	CH₃CHNH	ethanimine	ethanimine
820	NH₂BHNH₂	diaminoborane	nh2bhnh2
821	C₂H₅NH⁺	Protonated Aziridine	c2h5nh+
822	C₂H₆N⁺	aziridine, protonated	c2h6n+
823	NH₂CH₂NH₂	diaminomethane	nh2ch2nh2
824	CH₃CH₂NH₂	Ethylamine	etam
825	CH₃NHCH₃	Dimethylamine	ch3nhch3
826	CH₃PHCH₃	dimethylphosphine	ch3phch3
827	NH₂CH₂NH₃⁺	diaminoethane, protonated	pdam
828	(CH₃)₂NH₂⁺	dimethylammonium cation	dmam
829	CH₃CH₂NH₃⁺	ethylamine, protonated	pea
830	Li₂O	dilithium oxide	li2o
831	Li₂O⁺	dilithium oxide cation	li2o+
832	Li₂S	dilithium sulfide	li2s
833	Na₂O	disodium monoxide	na2o
834	Na₂S	Sodium sulfide	na2s
835	LiO₂	Lithium dioxide	lio2
836	NaO₂	Sodium superoxide	nao2
837	CCO	Dicarbon monoxide	cco
838	CNO^-	fulminate	cno-
839	NCO	isocyanato radical	nco
840	NCO^-	cyanate	nco-
841	SCN	thiocyanato radical	scn
842	SCN^-	thiocyanide anion	scn-
843	BO₂	Boron dioxide	bo2
844	BO₂^-	Boron dioxide anion	bo2-
845	BO₂⁺	Boron dioxide cation	bo2+
846	N₂O	Nitrous oxide	n2o
847	N₂O^-	Nitrous oxide anion	n2o-
848	N₂O⁺	Nitrous oxide cation	n2o+
849	NNS	Nitrogen sulfide	nns
850	PPO	Phosphorus oxide phosphide	ppo
851	CO₂^-	Carbon dioxide anion	co2-
852	CO₂⁺	Carbon dioxide cation	co2+
853	OCS	Carbonyl sulfide	cos
854	OCS⁺	Carbonyl sulfide cation	cos+
855	SiO₂	silicon dioxide	sio2
856	CS₂	Carbon disulfide	cs2
857	CS₂^-	Carbon disulfide anion	cs2-
858	CS₂⁺	Carbon disulfide cation	cs2+
859	TiO₂	Titanium dioxide	tio2
860	SiS₂	Silicon disulfide	sis2
861	GeO₂	Germanium dioxide	geo2
862	OCSe	Carbonyl selenide	ocse
863	SCSe	Carbon sulfide selenide	scse
864	GeS₂	Germanium disulfide	ges2
865	CSe₂	Carbon diselenide	cse2
866	SCTe	Carbon sulfide Telluride	scte
867	NO₂	Nitrogen dioxide	no2
868	NO₂^-	Nitrogen dioxide anion	no2-
869	NO₂⁺	Nitrogen dioxide cation	no2+
870	NSO	sulfinyl amidogen	NSO
871	PO₂	Phosphorus dioxide	po2
872	PO₂^-	Phosphorus dioxide anion	po2-
873	PO₂⁺	Phosphorus dioxide cation	po2+
874	SNO	Nitrogen oxide sulfide	sno
875	AsO₂	Aresenic dioxide	aso2
876	O₃	Ozone	o3
877	O₃^-	Ozone anion	o3-
878	O₃⁺	Ozone cation	o3+
879	SO₂^-	Sulfur dioxide anion	so2-
880	SO₂⁺	Sulfur dioxide cation	so2+
881	SSO	Disulfur monoxide	sso
882	S₃^-	Sulfur trimer anion	s3-
883	S₃⁺	Sulfur trimer cation	s3+
884	SeO₂	Selenium dioxide	seo2
885	SeO₂⁺	Selenium dioxide cation	seo2+
886	TeO₂	Tellurium Dioxide	teo2
887	HCCO	ketenyl radical	ketenyl
888	CS₂H⁺	Carbon disulfide, protonated	cs2h+
889	HCNO	fulminic acid	hcno
890	HNCO	Isocyanic acid	hnco
891	HOCN	cyanic acid	hocn
892	HNCS	Isothiocyanic acid	hncs
893	HSCN	thiocyanic acid	hscn
894	HCO₂^-	formate anion	hco2-
895	HNNO	nitrosoazane	hnno
896	HNNO⁺	Nitrous oxide, N-protonated	hnno+
897	NNOH⁺	Nitrous Oxide, O-protonated	nnoh+
898	HCOO	formate neutral radical	hcoo
899	HOCO⁺	Hydrocarboxyl cation	hoco+
900	HNO₂	Nitrous acid	hno2
901	HNO₂⁺	nitrous acid cation	hno2+
902	O₃H⁺	protonated ozone	o3h+
903	SO₂H⁺	protonated sulfur dioxide	so2h+
904	C₂H₂O	Oxirene	oxirene
905	CH₂CO	Ketene	ch2co
906	CH₂CO⁺	Ketene cation	ch2co+
907	HCCOH	ethynol	hccoh
908	CH₂CS	Thioketene	ch2cs
909	Be(OH)₂	Beryllium hydroxide	beo2h2
910	Mg(OH)₂	Magnesium dihydroxide	h2mgo2
911	NH₂NO	Nitrosamide	nh2no
912	CH₂O₂	Dioxirane	diox
913	H₂COO	Dioxymethyl radical	h2coo
914	H₂COO⁺	dioxymethyl cation	h2coo+
915	HCOOH	Formic acid	ch2o2
916	H₂O₃	Hydrogen trioxide	h2o3
917	HSSSH	trisulfane	hsssh
918	NaOCH₃	Sodium methoxide	naoch3
919	CH₂BOH	hydroxy(methylene)borane	ch2boh
920	BH₃CO	Borane carbonyl	bh3co
921	CH₃BO	Borane, methyloxo-	ch3bo
922	CH₂CHO	Vinyloxy radical	ch2cho
923	CH₂COH⁺	ketene, protonated	ch2coh+
924	CH₃CO^-	Acetyl anion	ch3co-
925	CH₃CO⁺	acetyl cation	ch3co+
926	CH₂NOH	formaldoxime	ch2noh
927	CH₃NO	nitrosomethane	ch3no
928	CHONH₂	formamide	formamide
929	CNOH₃	1,2-oxaziridine	cnoh3
930	HOCHNH	hydroxymethylimine	hochnh
931	CHSNH₂	thioformamide	chsnh2
932	NHCHSH	Methanimidothioic acid	nhchsh
933	CH₂OOH	CH2OOH radical	ch2ooh
934	CH₃OO	methylperoxy radical	ch3oo
935	CH₃OO^-	methylperoxy anion	ch3oo-
936	CH₃OO⁺	methylperoxy cation	ch3oo+
937	C₂H₄O	Ethylene oxide	c2h4o
938	C₂H₄O⁺	ethylene oxide cation	c2h4o+
939	CH₂CHOH	ethenol	ch2choh
940	CH₃CHO	Acetaldehyde	ch3cho
941	CH₃CHO⁺	acetaldehyde cation	ch3cho+
942	H₂COCH₂⁺	Methyl, (methyleneoxoniumyl)-	h2coch2+
943	C₂H₄S	Thiirane	thiirane
944	CH₂CHSH	Ethenethiol	ch2chsh
945	CH₃CHS	Thioacetaldehyde	ch3chs
946	H₂CONH₂⁺	protonated formamide	h2conh2+
947	NH₂CHOH⁺	Formamide, O-protonated	nh2choh+
948	NH₃CHO⁺	Formamide, N-Protonated	nh3cho+
949	CH₂(OH)₂	methanediol	ch2o2h2
950	CH₃OOH	Methyl peroxide	ch3ooh
951	CH₃SSH	Hydrogen methyl disulfide	ch3ssh
952	HSCH₂SH	Methanedithiol	ch4s2
953	H₂OH₂CO	water formaldehyde dimer	h2oh2co
954	C₂H₄OH⁺	ethylene oxide, protonated	c2h4oh+
955	CH₂CH₂OH	2-hydroxy ethyl radical	ch2ch2oh
956	CH₃CH₂O	Ethoxy radical	ethoxy
957	CH₃CHOH	1-hydroxy-ethyl radical	ch3choh
958	CH₃CHOH⁺	acetaldehyde, protonated	ch3choh+
959	CH₃OCH₂	methoxymethyl radical	ch3och2
960	NH₂CH₂OH	aminomethanol	nh2ch2oh
961	CH₃CH₂OH	Ethanol	etoh
962	CH₃OCH₃	Dimethyl ether	meome
963	CH₃CH₂SH	ethanethiol	etsh
964	CH₃SCH₃	Dimethyl sulfide	mesme
965	CH₃SCH₃⁺	dimethyl sulfide cation	mesme+
966	CH₃SeCH₃	dimethylselenide	dmse
967	CH₃OHH₂O	methanol water dimer	ch3ohh2o
968	H₂OCH₃OH	water methanol dimer	h2och3oh
969	CuF₂	Copper difluoride	cuf2
970	ZnF₂	Zinc difluoride	znf2
971	CNF	iso cyanogen fluoride	cnf
972	FCN	Cyanogen fluoride	fcn
973	ClCN	chlorocyanogen	clcn
974	BrCN	Cyanogen bromide	brcn
975	ICN	Cyanogen iodide	icn
976	FBO	Boron monofluoride monoxide	fbo
977	BeF₂	Beryllium fluoride	bef2
978	MgF₂	Magnesium fluoride	mgf2
979	BeCl₂	Beryllium chloride	becl2
980	MgCl₂	Magnesium dichloride	mgcl2
981	CaCl₂	Calcium Chloride	cacl2
982	ZnCl₂	Zinc dichloride	zncl2
983	BeBr₂	Beryllium bromide	bebr2
984	CaBr₂	Calcium dibromide	cabr2
985	CaF₂	Calcium difluoride	caf2
986	FCO	Carbonyl fluoride	fco
987	FCO⁺	Carbonyl fluoride cation	fco+
988	ClCO	carbonyl monochloride	clco
989	BF₂	Boron difluoride radical	bf2
990	FNO	Nitrosyl fluoride	fno
991	ClNO	Nitrosyl chloride	clno
992	FNS	Thionitrosyl fluoride	fns
993	FSN	Thiazyl fluoride	fsn
994	OPCl	Phosphorus oxychloride	opcl
995	BrNO	Nitrosyl bromide	brno
996	INO	Nitrosyl iodide	ino
997	CF₂	Difluoromethylene	cf2
998	CF₂^-	Difluoromethylene anion	cf2-
999	CF₂⁺	Difluoromethylene cation	cf2+
1000	CFCl	chlorofluoromethylene	cfcl
1001	SiF₂	Silicon difluoride	sif2
1002	SiF₂⁺	Silicon difluoride cation	sif2+
1003	CCl₂	dichloromethylene	ccl2
1004	CCl₂^-	dichloromethylene anion	ccl2-
1005	CCl₂⁺	dichloromethylene cation	ccl2+
1006	SiCl₂	Dichlorosilylene	sicl2
1007	GeF₂	Germanium difluoride	gef2
1008	GeCl₂	Germanium dichloride	gecl2
1009	CBr₂	dibromomethylene	cbr2
1010	FOO	Dioxygen monofluoride radical	foo
1011	FOO⁺	Fluorine dioxide cation	foo+
1012	ClOO	chloroperoxy radical	cloo
1013	ClOO⁺	chloroperoxy cation	cloo+
1014	OClO	Chlorine dioxide	oclo
1015	OClO^-	Chlorine dioxide anion	oclo-
1016	OClO⁺	Chlorine dioxide cation	oclo+
1017	ClSO	Sulfur chloride oxide	clso
1018	ClS₂	Sulfur chloride	cls2
1019	BrOO	Bromine dioxide	broo
1020	OBrO	Bromine dioxide radical	obro
1021	NF₂	Difluoroamino radical	nf2
1022	NF₂⁺	Difluoroamino cation	nf2+
1023	PF₂	Phosphorus difluoride	pf2
1024	PF₂⁺	Phosphorus difluoride cation	pf2+
1025	FClO	chlorosyl fluoride	fclo
1026	F₂O	Difluorine monoxide	f2o
1027	ClOF	Chlorine hypofluorite	clof
1028	SF₂	sulfur difluoride	sf2
1029	SF₂^-	sulfur difluoride anion	sf2-
1030	SF₂⁺	sulfur difluoride cation	sf2+
1031	Cl₂O	Dichlorine monoxide	cl2o
1032	SCl₂	Sulfur dichloride	scl2
1033	SeF₂	Selenium difluoride	sef2
1034	BrOCl	Bromine hypochlorite	brocl
1035	SeCl₂	Selenium Dichloride	secl2
1036	SBr₂	Sulfur dibromide	sbr2
1037	SeBr₂	Selenium dibromide	sebr2
1038	BrOBr	Bromine oxide	brobr
1039	F₃^-	trifluoride anion	f3-
1040	Cl₃^-	trichloride anion	cl3-
1041	Br₃^-	tribromide anion	br3-
1042	I₃^-	triiodide	i3-
1043	SFCl	Sulfur chloride fluoride	sfcl
1044	HCCF	Fluoroacetylene	hccf
1045	HCCF⁺	fluoroacetylene cation	hccf+
1046	HCCCl	Chloroacetylene	hcccl
1047	HCCBr	bromoacetylene	hccbr
1048	HFCO	formyl fluoride	hfco
1049	HFCO⁺	formyl fluoride cation	hfco+
1050	COHCl	Formyl chloride	cohcl
1051	COHBr	Formyl bromide	cohbr
1052	BHF₂	Difluoroborane	bhf2
1053	BHCl₂	Borane, dichloro-	bhcl2
1054	CHCl₂	dichloromethyl radical	chcl2
1055	CHF₂	difluoromethyl radical	chf2
1056	CHF₂⁺	difluoromethyl cation	chf2+
1057	CHFCl	Chlorofluoromethyl radical	chfcl
1058	CHFCl⁺	Chlorofluoromethyl cation	chfcl+
1059	CHCl₂⁺	dichloromethyl cation	chcl2+
1060	CHBr₂	dibromomethyl radical	chbr2
1061	HOClO	Chlorous acid	hoclo
1062	NHF₂	difluoramine	nhf2
1063	NHCl₂	dichloroamine	nhcl2
1064	CH₂F₂	Methane, difluoro-	ch2f2
1065	CH₂FCl	fluorochloromethane	ch2fcl
1066	SiH₂F₂	difluorosilane	sih2f2
1067	CH₂Cl₂	Methylene chloride	ch2cl2
1068	CH₂BrF	Methane, bromofluoro-	ch2fbr
1069	CH₂BrCl	Methane, bromochloro-	ch2clbr
1070	CH₂FI	fluoroiodomethane	ch2fi
1071	CH₂Br₂	dibromomethane	ch2br2
1072	CH₂ClI	chloroiodomethane	ch2cli
1073	CH₂BrI	bromoiodomethane	ch2bri
1074	CH₂I₂	Diiodomethane	ch2i2
1075	SiH₂Cl₂	dichlorosilane	sih2cl2
1076	CH₃MgBr	Methyl Magnesium Bromide	ch3mgbr
1077	CH₂CHF	Ethene, fluoro-	ch2chf
1078	CH₂CHF⁺	fluoroethene cation	ch2chf+
1079	C₂H₃Cl	Ethene, chloro-	ch2chcl
1080	C₂H₃Br	vinyl bromide	c2h3br
1081	C₂H₃I	Vinyl iodide	c2h3i
1082	CH₂FOH	fluoromethanol	ch2foh
1083	CH₃OCl	methyl hypochlorite	ch3ocl
1084	CH₂CH₂Cl	2-chloroethyl radical	ch2ch2cl
1085	CHClCH₃	1-chloroethyl radical	chclch3
1086	C₂H₅F	fluoroethane	c2h5f
1087	CH₃CH₂Cl	Ethyl chloride	c2h5cl
1088	CH₃SiFH₂	fluoromethylsilane	ch3sifh2
1089	C₂H₅Br	Ethyl bromide	etbr
1090	C₂H₅I	Ethyl iodide	c2h5i
1091	KrF₂	Krypton difluoride	krf2
1092	XeF₂	Xenon difluoride	xef2
1093	B₄H₁₀	Tetraborane(10)	b4h10
1094	C₄	Carbon tetramer	c4
1095	C₄⁺	Carbon tetramer cation	c4+
1096	C₄H₂	Diacetylene	c4h2
1097	C₄H₂⁺	diacetlyene cation	c4h2+
1098	C₂H₃CCH	1-Buten-3-yne	c2h3cch
1099	C₄H₄	cyclobutadiene	cbd
1100	C₄H₄	Tetrahedrane	c4h4
1101	H₂CCCCH₂	Butatriene	h2cccch2
1102	C₄H₆	1-Methylcyclopropene	c3100047
1103	C₄H₆	Cyclobutene	c822355
1104	C₄H₆	Methylenecyclopropane	c6142730
1105	CH₂CCHCH₃	1,2-Butadiene	butad12
1106	CH₂CHCHCH₂	1,3-Butadiene	c106990
1107	CH₃CCCH₃	2-Butyne	c503173
1108	CHCCH₂CH₃	1-Butyne	c107006
1109	CH₃CHCHCH₂	methylallyl radical	c4h7
1110	C₄H₈	methylcyclopropane	mcp
1111	CH₂C(CH₃)CH₃	1-Propene, 2-methyl-	isobute
1112	CH₂CHCH₂CH₃	1-Butene	bute1
1113	CH₃CHCHCH₃	2-Butene, (E)-	bute2e
1114	CH₃CHCHCH₃	2-Butene, (Z)-	bute2z
1115	B(CH₃)₃	trimethylborane	bme3
1116	Al(CH₃)₃	trimethyl aluminum	tma
1117	C(CH₃)₃	Tert-butyl radical	tbutyl
1118	CH₂CH(CH₃)₂	Isobutyl radical	isobutyl
1119	CH₃CHCH₂CH₃	2-Butyl radical	butyl2
1120	CH₃CH(CH₃)CH₃	Isobutane	isobutane
1121	CH₃CH₂CH₂CH₃	Butane	butane
1122	SiH(CH₃)₃	trimethylsilane	trimsi
1123	Li₃N	trilithium nitride	li3n
1124	C₂N₂	Cyanogen	c2n2
1125	C₂N₂⁺	Cyanogen cation	c2n2+
1126	P₄	Phosphorus tetramer	p4
1127	As₄	Arsenic tetramer	as4
1128	HCCCN	Cyanoacetylene	hcccn
1129	HCCCN⁺	Cyanoacetylene cation	hcccn+
1130	H₂CNCN	cyanamide, methylene	ch2ncn
1131	HNCCNH	Ethenediimine	hnccnh
1132	C₃H₃N	acrylonitrile	ch2chcn
1133	C₃H₃N⁺	acrylonitrile cation	ch2chcn+
1134	CH₃N₃	methyl azide	ch3n3
1135	NH₂CCNH₂	Diaminoacetylene	daa
1136	NH₂CH₂CN	Aminoacetonitrile	aan
1137	CH₃NHN₂⁺	methyl azide, protonated	ch3nhn2+
1138	C₂H₅CN	ethyl cyanide	c2h5cn
1139	CH₅N₃	Guanidine	guanidine
1140	C₄H₆	Bicyclo[1.1.0]butane	c157335
1141	CH₃NNCH₃	(Z)-1,2-Dimethyldiazene	dmdiazz
1142	H₂NCHCHNH₂	diaminoethylene	dae
1143	CH₆N₃⁺	guanidinium	ch6n3+
1144	C₃H₇N	Cyclopropylamine	cpram
1145	CH₇N₃	triaminomethane	tam
1146	C₃H₇N	Azetidine	azet
1147	C₄H₈	cyclobutane	cbutane
1148	C₂H₈N₂	Ethylenediamine	ethdiam
1149	CH₃NHNHCH₃	dimethyl hydrazine	dmh
1150	CH₃CH(NH₂)CH₃	2-Propanamine	pram2
1151	N(CH₃)₃	Trimethylamine	trimeam
1152	NH₂CH₂CH₂CH₃	1-Propanamine	pram1
1153	P(CH₃)₃	trimethylphosphine	tmp
1154	N(SiH₃)₃	trisilylamine	tsa
1155	(CH₃)₃NH⁺	protonated trimethyl amine	ptma
1156	C₃H₇NH₃⁺	n-propylamine, protonated	c3h7nh2
1157	Li₂O₂	dilithium dioxide	li2o2
1158	Na₂O₂	disodium dioxide	na2o2
1159	K₂O₂	dipotassium dioxide	k2o2
1160	C₃O	Tricarbon monoxide	c3o
1161	B₂O₂	Diboron dioxide	b2o2
1162	ONNO	NO dimer	onno
1163	S₂N₂	Disulfur dinitride	s2n2
1164	CO₃	Carbon trioxide	co3
1165	CO₃^--	carbonate	co3--
1166	CS₃^--	Carbonotrithioate	cs3--
1167	NO₃	Nitrogen trioxide	no3
1168	NO₃^-	nitrate anion	no3-
1169	NO₃⁺	nitrogen trioxide cation	no3+
1170	SO₃	Sulfur trioxide	so3
1171	SO₃^-	Sulfur trioxide anion	so3-
1172	SO₃^--	Sulfate dianion	so3--
1173	SO₃⁺	Sulfur trioxide cation	so3+
1174	SeO₃	selenium trioxide	seo3
1175	S₄	Sulfur tetramer	s4
1176	TeO₃	Tellurium trioxide	teo3
1177	HCO₃^-	bicarbonate anion	hco3-
1178	HNO₃	Nitric acid	hno3
1179	HSO₃	Hydroxysulfonyl radical	hso3
1180	NH₂NO₂	nitramide	nh2no2
1181	C₂H₂CO	cyclopropenone	c2h2co
1182	C₃H₂O	Propadienal	c3h2o
1183	HCCCHO	2-propynal	hcccho
1184	C₂H₂O₂	Ethanedial	c2h2o2
1185	C₂H₂O₂⁺	Ethanedial cation	c2h2o2+
1186	H₂CO₃	Carbonic acid	h2co3
1187	H₂CS₃	thiocarbonic acid	h2cs3
1188	H₂NO₃⁺	Nitric Acid, Protonated	h2no3+
1189	H₂SO₃	Sulfurous acid	h2so3
1190	C₂H₃NO	Nitrosoethylene	c2h3no
1191	CH₃NCO	methylisocyante	ch3nco
1192	HOCH₂CN	cyanomethanol	hoch2cn
1193	CH₃COO^-	acetate anion	ch3coo-
1194	CH₃NO₂	Methane, nitro-	ch3no2
1195	CH₃ONO	Methyl nitrite	ch3ono
1196	NH₂COOH	Carbamic acid	nh2cooh
1197	H₃BO₃	Boric acid	h3bo3
1198	H₃AlO₃	Aluminum hydroxide	h3alo3
1199	H₃CO₃⁺	carbonic acid, protonated	h3co3+
1200	C₃H₄O	2-Propyn-1-ol	c107197
1201	C₃H₄O	allenol	c9000071
1202	C₃H₄O	Cyclopropanone	cpone
1203	C₃H₄O	Methylketene	c6004440
1204	CH₂CHCHO	Acrolein	c3h4o
1205	NH₂CONH₂	Urea	urea
1206	NH₂CONH₂⁺	Urea cation	urea+
1207	NH₂CSNH₂	Thiourea	thiourea
1208	C₂H₄O₂	1,3-dioxetane	c2h4o2
1209	CH₃COOH	Acetic acid	ch3cooh
1210	CH₃OCHO	methyl formate	ch3ocho
1211	CHOCH₂OH	hydroxy acetaldehyde	haa
1212	NH₂COOH₂⁺	Carbamic acid, O-protonated	nh2cooh2+
1213	NH₃COOH⁺	protonated Carbamic acid	nh3cooh+
1214	H₂OHCOOH	Water formic acid dimer 1	h2ohcooh_10
1215	H₂OHCOOH	Water formic acid dimer 2	h2ohcooh_11
1216	HCOOHH₂O	Formic acid water dimer	hcoohh2o
1217	HOCH₂OOH	hydroxy methyl peroxide	hoch2ooh
1218	CH₃COCH₂	Acetonyl radical	ch3coch2
1219	CH₂C(OH)NH₂	1-amino vinyl alchohol	ava
1220	CH₃C(OH)=NH	Ethaninidic acid	eia
1221	CH₃CHNOH	Acetaldoxime	acetaldoxime
1222	CH₃CONH₂	Acetamide	acetamide
1223	HCONHCH₃	N-methylformamide	nmfa
1224	CH₃CSNH₂	Ethanethioamide	ch3csnh2
1225	CH₅N₂O⁺	urea, N-protonated	ch4n2o+
1226	H₂NCOHNH₂⁺	urea, protonated	ureah+
1227	C₂H₅OO	ethylperoxy radical	c2h5oo
1228	CH₃NNCH₃	(E)-1,2-Dimethyldiazene	dmdiaze
1229	C₃H₅OH	Cyclopropanol	cproh
1230	C₃H₆O	2-Propen-1-ol	c107186
1231	C₃H₆O	Acetone enol	enol
1232	C₃H₆O	Oxetane	oxetane
1233	C₃H₆O	Propylene oxide	prox
1234	CH₃CH₂CHO	Propanal	propanal
1235	CH₃COCH₃	Acetone	acetone
1236	CH₃COCH₃^-	acetone anion	ch3coch3-
1237	C₃H₆S	Thietane	thietane
1238	C₃H₆S	Thiirane, methyl-	methiirane
1239	CH₃CSCH₃	Thioacetone	ch3csch3
1240	C₂H₆O₂	1,2-Ethanediol	ethdiol
1241	CH₃OOCH₃	dimethylperoxide	dmp
1242	CH₃SOCH₃	Dimethyl sulfoxide	dmso
1243	CH₂SHCH₂SH	1,2-Ethanedithiol	ethdisl
1244	CH₃SSCH₃	Disulfide, dimethyl	ch3ssch3
1245	CH₃COHCH₃⁺	acetone, protonated	acetoneh+
1246	HOCH₂CH₂NH₂	monoethanolamine	mea
1247	C₃H₇OH	1-Propanol	proh
1248	CH₃CHOHCH₃	Isopropyl alcohol	isoproh
1249	CH₃OC₂H₅	Ethane, methoxy-	etome
1250	C₃H₇SH	1-Propanethiol	prsh
1251	CH₃CHSHCH₃	2-Propanethiol	isoprsh
1252	CH₃SCH₂CH₃	Ethane, (methylthio)-	etsme
1253	H₂OCH₃OCH₃	water dimethylether dimer	h2och3och3
1254	Li₂F₂	Lithium fluoride dimer	li2f2
1255	Na₂F₂	Sodium Fluoride Dimer	na2f2
1256	Na₂Cl₂	Disodium dichloride	na2cl2
1257	C₂F₂	difluoroacetylene	c2f2
1258	C₂Cl₂	dichloroacetylene	c2cl2
1259	C₂Cl₂⁺	dichloroacetylene cation	c2cl2+
1260	FNO₂	Nitryl fluoride	fno2
1261	FONO	Nitrosyl hypofluorite	fono
1262	ClNO₂	Nitryl chloride	clno2
1263	ClONO	chlorine nitrite	clono
1264	BrONO	Bromine nitrite	brono
1265	N₂F₂	(Z)-Difluorodiazene	n2f2_z
1266	N₂F₂	Dinitrogen difluoride, (E)-	n2f2_e
1267	CF₂O	Carbonic difluoride	f2co
1268	CF₂O⁺	Carbonic difluoride cation	f2co+
1269	COFCl	Carbonic chloride fluoride	cofcl
1270	CCl₂O	Phosgene	cl2co
1271	Cl₂CS	Thiophosgene	cl2cs
1272	COBr₂	Carbonic dibromide	cobr2
1273	BF₃^-	Borane, trifluoro- anion	bf3-
1274	BF₃⁺	boron trifluoride cation	bf3+
1275	BClF₂	Chlorodifluoroborane	bclf2
1276	AlF₂Cl	Aluminum chloride difluoride	alclf2
1277	ScF₃	Scandium trifluoride	ScF3
1278	AlFCl₂	Aluminum dichloride fluoride	alcl2f
1279	BCl₃	Borane, trichloro-	bcl3
1280	BCl₃⁺	Boron Trichloride cation	bcl3+
1281	GaF₃	Gallium trifluoride	gaf3
1282	AlCl₃	Aluminum trichloride	alcl3
1283	GaCl₃	Gallium trichloride	gacl3
1284	BBr₃	Boron tribromide	bbr3
1285	AlBr₃	Aluminum Bromide	albr3
1286	ClO₃	Chlorine trioxide	clo3
1287	ClO₃^-	chlorate anion	clo3-
1288	BrO₃^-	Bromate anion	bro3-
1289	CF₃	Trifluoromethyl radical	cf3
1290	CF₃^-	Trifluoromethyl anion	cf3-
1291	CF₃⁺	Trifluoromethyl cation	cf3+
1292	CF₂Cl	difluorochloromethyl radical	cf2cl
1293	SiF₃	Silicon trifluoride radical	sif3
1294	SiF₃⁺	Silicon trifluoride cation	sif3+
1295	CFCl₂	dichlorofluoromethyl radical	cfcl2
1296	CCl₃	Trichloromethyl radical	ccl3
1297	CCl₃^-	Trichloromethyl anion	ccl3-
1298	CCl₃⁺	Trichloromethyl cation	ccl3+
1299	SiCl₃	trichlorosilyl radical	sicl3
1300	SiCl₃⁺	trichlorosilyl cation	sicl3+
1301	CBr₃	tribromomethyl radical	cbr3
1302	FOOF	Perfluoroperoxide	foof
1303	ClO₂F	Chloryl fluoride	clo2f
1304	F₂SO	Thionyl Fluoride	f2so
1305	ClOOCl	Dichlorine dioxide	cloocl
1306	FSSF	Difluorodisulfane	fssf
1307	S₂F₂	Thio-thionyl fluoride	s2f2
1308	SOCl₂	thionyl chloride	socl2
1309	SSCl₂	Thiothionyl chloride	sscl2
1310	SeOCl₂	selenium oxychloride	seocl2
1311	NF₃	Nitrogen trifluoride	nf3
1312	NF₃^-	Nitrogen trifluoride anion	nf3-
1313	NF₃⁺	Nitrogen trifluoride cation	nf3+
1314	PF₃	Phosphorus trifluoride	pf3
1315	NCl₃	nitrogen trichloride	ncl3
1316	AsF₃	Arsenic trifluoride	asf3
1317	PCl₃	Phosphorus trichloride	pcl3
1318	SbF₃	Antimony Trifluoride	sbf3
1319	AsCl₃	Arsenous trichloride	ascl3
1320	SbCl₃	Antimony Trichloride	sbcl3
1321	NBr₃	Nitrogen Tribromide	nbr3
1322	PBr₃	Phosphorus tribromide	pbr3
1323	AsBr₃	Arsenic tribromide	asbr3
1324	NI₃	Nitrogen triiodide	ni3
1325	PI₃	Phosphorus triiodide	pi3
1326	ClSSCl	Disulfur dichloride	s2cl2
1327	SF₃	Sulfur trifluoride	sf3
1328	ClF₃	Chlorine trifluoride	clf3
1329	BrF₃	Bromine trifluoride	brf3
1330	IF₃	iodone trifluoride	if3
1331	HClO₃	Chloric Acid	hclo3
1332	CHF₃	Methane, trifluoro-	chf3
1333	CHF₂Cl	difluorochloromethane	chf2cl
1334	SiHF₃	trifluorosilane	sihf3
1335	CHFCl₂	fluorodichloromethane	chfcl2
1336	CDCl₃	trichloromethane-d	cdcl3
1337	CHCl₃	Chloroform	chcl3
1338	CHBrF₂	Methane, bromodifluoro-	chbrf2
1339	SiHCl₃	Trichlorosilane	sihcl3
1340	CHFClBr	fluorochlorobromomethane	chfclbr
1341	CHBrCl₂	Methane, bromodichloro-	chbrcl2
1342	CHF₂I	difluoroiodomethane	chf2i
1343	CHBr₂F	dibromofluoromethane	chbr2f
1344	CHFClI	fluorochloroiodomethane	chfcli
1345	CHCl₂I	dichloroiodomethane	chcl2i
1346	CHClBr₂	Methane, dibromochloro-	chclbr2
1347	CHBr₃	bromoform	chbr3
1348	CHI₃	Iodoform	chi3
1349	NF₃H⁺	protonated nitrogen trifluoride	nf3h+
1350	AsF₃H⁺	Arsenic trifluoride, protonated	asf3h+
1351	C₂H₂F₂	Ethene, 1,2-difluoro-, (E)-	c2h2f2e
1352	C₂H₂F₂	Ethene, 1,2-difluoro-, (Z)-	c2h2f2z
1353	CH₂CF₂	Ethene, 1,1-difluoro-	ch2cf2
1354	C₂H₂ClF	1-chloro-1-fluoroethylene	c2h2clf
1355	CHFCHCl	(E)-1-chloro-2-fluoroethene	chfchcle
1356	CHFCHClz	(Z)-1-Chloro-2-fluoroethene	chfchclz
1357	CH₂CCl₂	Ethene, 1,1-dichloro-	ch2ccl2
1358	CHClCHCl	Ethene, 1,2-dichloro-, (E)-	chclchcle
1359	CHClCHCl	Ethene, 1,2-dichloro-, (Z)-	chclchclz
1360	C₂H₂Br₂	1,1-dibromoethene	c2h2br2
1361	CHBrCHBr	Ethene, 1,2-dibromo-, (E)-	chbrchbre
1362	CHBrCHBr	Ethene, 1,2-dibromo-, (Z)-	chbrchbrz
1363	CH₂FCHO	Fluoroacetaldehyde	ch2fcho
1364	CH₃COF	Acetyl fluoride	ch3cof
1365	CH₂ClCHO	chloroacetaldehyde	ch2clcho
1366	CH₃COCl	Acetyl Chloride	ch3cocl
1367	C₂H₄F₂	1,2-difluoroethane	c2h4f2
1368	CH₃CHF₂	Ethane, 1,1-difluoro-	ch3chf2
1369	CH₂FCH₂Cl	Ethane, 1-chloro-2-fluoro-	ch2fch2cl
1370	CH₃CHFCl	Ethane, 1-chloro-1-fluoro-	ch3chfcl
1371	CH₂ClCH₂Cl	Ethane, 1,2-dichloro-	ch2clch2cl
1372	CH₃CHCl₂	Ethane, 1,1-dichloro-	ch3chcl2
1373	CH₂BrCH₂Cl	1-bromo-2-chloroethane	ch2brch2cl
1374	CH₂BrCH₂Br	Ethane, 1,2-dibromo-	ch2brch2br
1375	CH₂CFCH₃	2-fluoropropene	2fpro
1376	CH₂CHCH₂F	Allyl Fluoride	allylf
1377	CH₃CHCHF	trans-1-Fluoro-1-propene	propene1ft
1378	C₃H₅Cl	1-Propene, 3-chloro-	prop1cl3
1379	C₃H₅Cl	1-chloro-1-propene(E)	prop1cl1e
1380	C₃H₅Cl	1-chloro-1-propene(Z)	prop1cl1z
1381	CH₂FCH₂OH	2-fluoroethanol	ch2fch2oh
1382	CH₂ClCH₂OH	2-Chloroethanol	ch2clch2oh
1383	CH₂ClCH₂OH₂⁺	2-chloroethanol, protonated	ch2clch2oh2+
1384	CH₂FCH₂CH₃	1-Fluoropropane	prf1
1385	CH₃CHFCH₃	2-Fluoropropane	prf2
1386	CH₂ClCH₂CH₃	Propane, 1-chloro-	prcl1
1387	CH₃CHClCH₃	Propane, 2-chloro-	prcl2
1388	CH₃CH₂CH₂Br	n-propyl bromide	prbr
1389	CH₃CHBrCH₃	i-propyl bromide	iprbr
1390	C₃H₉O⁺	trimethyl oxonium cation	c3h9o+
1391	B₅H₉	pentaborane9	b5h9
1392	C₅H₄	pentatetraene	ptrene
1393	C₅H₅	cyclopentadienyl radical	c5h5
1394	C₅H₅^-	cylopentadienyl anion	c5h5-
1395	C₅H₆	1,3-Cyclopentadiene	c542927
1396	C₅H₆	1-Buten-3-yne, 2-methyl-	c78808
1397	C₅H₆	3-Penten-1-yne, (E)-	c2004695
1398	C₅H₆	3-Penten-1-yne, (Z)-	c1574409
1399	C₅H₆	Bicyclo[2.1.0]pent-2-ene	c5164352
1400	C₅H₆	Cyclopropylacetylene	c6746947
1401	C₅H₆	Propellane	propellane
1402	C₅H₇	1,3-pentadienyl radical	pdyl
1403	C₅H₇	cyclopentenyl radical	cpyl
1404	C₅H₈	1,2-Butadiene, 3-methyl-	c598254
1405	C₅H₈	1,2-Pentadiene	c591957
1406	C₅H₈	1,3-Butadiene, 2-methyl-	c78795
1407	C₅H₈	1,3-Pentadiene, (E)-	c2004708
1408	C₅H₈	1,3-Pentadiene, (Z)-	c1574410
1409	C₅H₈	1,4-Pentadiene	c591935
1410	C₅H₈	1-pentyne	a1pentyne
1411	C₅H₈	2,3-Pentadiene	c591968
1412	C₅H₈	Bicyclo[1.1.1]pentane	bcp
1413	C₅H₈	Cyclobutane, methylene-	c1120565
1414	C₅H₈	Cyclopentene	c142290
1415	C₅H₈	Ethenylcyclopropane	c693867
1416	CH₃CCCH₂CH₃	2-Pentyne	2pentyne
1417	C₅H₁₀	1-Butene, 2-methyl-	c563462
1418	C₅H₁₀	2-Butene, 2-methyl-	c513359
1419	C₅H₁₀	2-Pentene, (E)-	c646048
1420	C₅H₁₀	2-Pentene, (Z)-	c627203
1421	C₅H₁₀	Cyclopentane	c287923
1422	C₅H₁₀	Cyclopropane, 1,1-dimethyl-	c1630940
1423	CH₂CHCH₂CH₂CH₃	1-pentene	pentene
1424	C₅H₁₁	2-Methylbut-2-yl radical	c4348350
1425	C₅H₁₂	Butane, 2-methyl-	buta2
1426	C₅H₁₂	Pentane	pentane
1427	C₅H₁₂	Propane, 2,2-dimethyl-	neopentane
1428	Si(CH₃)₄	tetramethylsilane	tms
1429	N₂O₃	Dinitrogen trioxide	n2o3
1430	C₃H₂N₂	Malononitrile	c3h2n2
1431	CH₂N₄	1H-Tetrazole	1htz
1432	C₃H₃N₂	imidazolyl radical	im
1433	C₃H₃N₂^-	imidizolyl anion	im-
1434	C₂H₃N₃	1H-1,2,4-Triazole	c288880
1435	C₄H₄N	pyrrolide radical	c4h4n
1436	C₄H₄N^-	pyrrolide anion	c4h4n-
1437	C₃H₄N₂	1H-Imidazole	1himidaz
1438	C₃H₄N₂	1H-Pyrazole	1hpyraz
1439	C₃H₄N₂	2H-Imidazole	imid2h
1440	C₃H₄N₂	4H-Imidazole	imid4h
1441	C₄H₅N	(E)-2-Butenenitrile	c627269
1442	C₄H₅N	(Z)-2-Butenenitrile	c1190767
1443	C₄H₅N	2H-pyrrole	pyrrole2
1444	C₄H₅N	3H-pyrrole	pyrrole3
1445	C₄H₅N	Cyclopropanecarbonitrile	c5500210
1446	C₄H₅N	Pyrrole	pyrrole
1447	CH₂CHCH₂CN	Allylcyanide	ch2chch2cn
1448	C₄H₆N⁺	pyrrole, alpha-protonated	appyr
1449	C₄H₆N⁺	pyrrole, beta-protonated	bppyr
1450	C₄H₆N⁺	pyrrole, protonated	ppyr
1451	C₃H₆N₂	3-Aminopropionitrile	c151188
1452	CH₃CH(CH₃)CN	Propanenitrile, 2-methyl-	c4h7n
1453	CH₃CH₂CH₂CN	Butanenitrile	c109740
1454	C₅H₈	Bicyclo[2.1.0]pentane	c185944
1455	C₅H₈	Spiropentane	c157404
1456	C₄H₉N	Cyclobutylamine	cbam
1457	C₄H₉N	Pyrrolidine	pyrrolidine
1458	C₃H₁₀N₂	1,2-Diaminopropane	diampr12
1459	C(CH₃)₃NH₂	2-Propanamine, 2-methyl-	c75649
1460	C(NH₂)H₂C(CH₃)HCH₃	1-Propanamine, 2-methyl-	c78819
1461	C(NH₂)H₂CH₂CH₂CH₃	1-Butanamine	butam1
1462	CH₃C(NH₂)HCH₂CH₃	2-Butanamine	butam2
1463	NH(C₂H₅)₂	diethylamine	dea
1464	NC₄H₁₂⁺	tetramethyl ammonium cation	nc4h12+
1465	C₃O₂	Carbon suboxide	c3o2
1466	C₃O₂⁺	Carbon suboxide cation	c3o2+
1467	B₂O₃	diboron trioxide	b2o3
1468	MgCO₃	Magnesium Carbonate	mgco3
1469	BeCO₃	Beryllium Carbonate	beco3
1470	CaCO₃	Calcium Carbonate	caco3
1471	ONONO	Nitrosyl nitrite	onono
1472	PO₄^---	phosphate	po4---
1473	SO₄^--	sulfate	so4--
1474	HOONO₂	peroxy nitric acid	hoono2
1475	HSO₄^-	bisulfate anion	hso4-
1476	C₂H₂N₂S	1,3,4-Thiadiazole	c2h2n2s
1477	C₃H₂O₂	Propiolic acid	c3h2o2
1478	CHOCOOH	oxo acetic acid	oaa
1479	CHOOCHO	diformyl ether	choocho
1480	H₂SO₄	Sulfuric acid	h2so4
1481	H₂SeO₄	Selenic acid	h2seo4
1482	C₃H₃NO	Isoxazole	isox
1483	C₃H₃NO	Oxazole	oxazole
1484	C₃H₃NS	Thiazole	thiazole
1485	CH₃C(O)OO	acetyl peroxy radical	ch3coo2
1486	CH₃NO₃	Methyl nitrate	ch3no3
1487	H₃PO₄	Phosphoric Acid	h3po4
1488	C₄H₄O	Furan	furan
1489	C₄H₄O⁺	Furan cation	furan+
1490	CH₃COCCH	3-butyn-2-one	c1423605
1491	C₄H₄S	Thiophene	furans
1492	C₄H₄Se	selenophene	c4h4se
1493	C₃H₄O₂	β–Propiolactone	beta
1494	C₃H₄O₂	2-Propenoic acid	propenoic2
1495	C₃H₄O₂	Methyl glyoxal	megly
1496	C₃H₄O₂	propanedial	propanedial
1497	C₃H₄O₂	propenalol	propenalol
1498	HOCHCCHOH	allenediol	aldiol
1499	C₂H₄O₃	1,2,3-trioxolane	c2h4o3
1500	C₂H₄O₃	trioxolane124	triox
1501	HOCH₂COOH	Hydroxyacetic acid	hac
1502	CH₂CHCONH₂	Acrylamide	c79061
1503	CH₃OCH₂CN	Methoxyacetonitrile	c1738369
1504	CH₅N₃S	Hydrazinecarbothioamide	c79196
1505	H₂NCH₂COOH	Glycine	glycine
1506	CH₃SO₂NH₂	methanesulfonamide	ch3so2nh2
1507	C₄H₆O	cis-2-butenal	butenal2c
1508	C₄H₆O	Cyclobutanone	cbutone
1509	C₄H₆O	Furan, 2,3-dihydro-	furan23h
1510	C₄H₆O	Furan, 2,5-dihydro-	furan25h
1511	CH₂CHOCHCH₂	Vinyl ether	vinylether
1512	CHOCHCHCH₃	2-Butenal	butenal2
1513	C₄H₆S	Thiophene, 2,3-dihydro-	thiop23h
1514	C₄H₆S	Thiophene, 2,5-dihydro-	thiop25h
1515	CH₂CHSCHCH₂	Divinyl sulfide	divis
1516	C₂H₆N₂O	Urea, methyl-	c598505
1517	C₃H₆O₂	1,3-Dioxolane	dioxolane
1518	CH₃CH₂COOH	Propanoic Acid	propanoic
1519	CH₃COOCH₃	methyl acetate	aame
1520	HCOOC₂H₅	Ethyl formate	faee
1521	C₂H₆O₂S	Dimethyl sulfone	c67710
1522	CH₃SSSCH₃	dimethyl trisulfide	c2h6s3
1523	C₃H₇NO	dimethylformamide	dmf
1524	C₃H₇NO	Propanamide	propanam
1525	C₂H₃OC₂H₅	Ethene, ethoxy-	c109922
1526	C₄H₈O	Cyclobutanol	c2919235
1527	C₄H₈O	Furan, tetrahydro-	thf
1528	CH₂C(CH₃)OCH₃	1-Propene, 2-methoxy-	pre1meo2
1529	CH₃COCH₂CH₃	2-Butanone	buta2one
1530	CHOCH(CH₃)CH₃	Propanal, 2-methyl-	c78842
1531	CHOCH₂CH₂CH₃	Butanal	butanal
1532	C₄H₈S	Thiophene, tetrahydro-	tht
1533	C₃H₈O₂	1,3-Propanediol	c504632
1534	C₃H₈O₂	Hydroperoxide, 1-methylethyl	c3031752
1535	C₃H₈O₂	Methane, dimethoxy-	c109875
1536	C₃H₈O₂	Propylene glycol	c57556
1537	C₃H₈S₂	1,3-Propanedithiol	c109808
1538	C₄H₁₀O	1-Butanol	butanol1
1539	C₄H₁₀O	1-Propanol, 2-methyl-	c78831
1540	C₄H₁₀O	2-Butanol, (.+/-.)-	butanol2
1541	C₄H₁₀O	Ethanol, 1,1-dimethyl-	tbuoh
1542	C₄H₁₀O	Ethoxy ethane	etoet
1543	C₄H₁₀O	Methyl propyl ether	meopr
1544	C₄H₁₀O	Propane, 2-methoxy-	c598538
1545	C₄H₁₀O⁺	1-Butanol cation	butanol1+
1546	C(CH₃)₃SH	2-Propanethiol, 2-methyl-	tbush
1547	C₂H₅SC₂H₅	Diethyl sulfide	etset
1548	C₄H₉SH	1-Butanethiol	bush
1549	CH₂(SH)CH(CH₃)CH₃	1-Propanethiol, 2-methyl-	c513440
1550	CH₃C(SCH₃)HCH₃	Propane, 2-(methylthio)-	mesipr
1551	CH₃CH(SH)CH₂CH₃	2-Butanethiol	butansl2
1552	FNO₃	Fluorine nitrate	fno3
1553	ClONO₂	Chlorine nitrate	clono2
1554	BrONO₂	Bromine nitrate	brono2
1555	TiCl₄	Titanium tetrachloride	ticl4
1556	ClO₄^-	perchlorate anion	clo4-
1557	BF₄^-	tetrafluoroboron anion	bf4-
1558	ClFO₃	Perchloryl fluoride	clfo3
1559	SO₂F₂	Sulfuryl fluoride	so2f2
1560	SO₂Cl₂	Sulfuryl chloride	so2cl2
1561	F₃NO	Nitrogen trifluoride oxide	f3no
1562	F₃PO	Phosphoryl fluoride	pf3o
1563	Cl₃PO	Phosphoryl chloride	pcl3o
1564	CF₄	Carbon tetrafluoride	cf4
1565	CF₃Cl	Methane, chlorotrifluoro-	cf3cl
1566	SiF₄	Silicon tetrafluoride	sif4
1567	CF₂Cl₂	difluorodichloromethane	cf2cl2
1568	TiF₄	Titanium tetrafluoride	tif4
1569	CFCl₃	Trichloromonofluoromethane	cfcl3
1570	CF₃Br	Bromotrifluoromethane	cf3br
1571	GeF₄	Germanium tetrafluoride	gef4
1572	CCl₄	Carbon tetrachloride	ccl4
1573	CCl₄⁺	Carbon tetrachloride cation	ccl4+
1574	CBrClF₂	Methane, bromochlorodifluoro-	cbrclf2
1575	SiCl₄	Silane, tetrachloro-	sicl4
1576	CBrCl₂F	bromodichlorofluoromethane	cbrcl2f
1577	CF₃I	trifluoroiodomethane	cf3i
1578	CBrCl₃	Methane, bromotrichloro-	cbrcl3
1579	CBr₂F₂	Methane, dibromodifluoro-	cbr2f2
1580	GeCl₄	Germanium Tetrachloride	gecl4
1581	CBr₂ClF	dibromochlorofluoromethane	cbr2clf
1582	CBr₂Cl₂	dibromodichloromethane	cbr2cl2
1583	CCl₃I	trichloroiodomethane	ccl3i
1584	CFBr₃	fluorotribromomethane	cfbr3
1585	CFClBrI	fluorochlorobromoiodomethane	cfclbri
1586	CBr₃Cl	tribromochloromethane	cbr3cl
1587	CF₂I₂	difluorodiiodomethane	cf2i2
1588	CBr₄	Carbon tetrabromide	cbr4
1589	CCl₂I₂	dichlorodiiodomethane	ccl2i2
1590	SiBr₄	Silicon tetrabromide	sibr4
1591	CBr₃I	tribromoiododmethane	cbr3i
1592	GeBr₄	Germanium tetrabromide	gebr4
1593	CI₄	tetraiodomethane	ci4
1594	SiI₄	silicon tetraiodide	sii4
1595	ClOF₃	Chlorine trifluoride oxide	clof3
1596	SF₄	Sulfur tetrafluoride	sf4
1597	SeF₄	Selenium tetrafluoride	sef4
1598	SCl₄	Sulfur tetrachloride	scl4
1599	C₂HF₃	Trifluoroethylene	c2hf3
1600	C₂HF₃⁺	Trifluoroethylene cation	c2hf3+
1601	CHClCCl₂	Trichloroethylene	chclccl2
1602	CHBrCF₂	1-Bromo-2,2-difluoroethylene	chbrcf2
1603	HClO₄	perchloric acid	hclo4
1604	HSO₃F	Fluorosulfonic acid	hso3f
1605	CF₃OH	trifluoromethanol	cf3oh
1606	CH₂ClCCCl	1,3-dichloropropyne	ch2clcccl
1607	CHClCCHCl	1,3-dichloroallene	chclcchcl
1608	CHCl₂CCH	3,3-dichloropropyne	chcl2cch
1609	CHCl₂CHO	dichloroacetaldehyde	chcl2cho
1610	PF₃CH₂	phosphorane, trifluoromethylene-	pf3ch2
1611	CH₃CF₃	Ethane, 1,1,1-trifluoro-	ch3cf3
1612	CHF₂CH₂F	Ethane, 1,1,2-trifluoro	ch2fchf2
1613	CH₃CF₂Cl	1-Chloro-1,1-Difluoroethane	ch3cf2cl
1614	CH₃CFCl₂	1,1-Dichloro-1-fluoroethane	ch3cfcl2
1615	CH₂ClCHCl₂	1,1,2-trichloroethane	ch2clchcl2
1616	CH₃CCl₃	Ethane, 1,1,1-trichloro-	ch3ccl3
1617	SiCl₃CH₃	methyltrichlorosilane	sicl3ch3
1618	CH₃CBr₃	1,1,1-tribromoethane	ch3cbr3
1619	NH₃BCl₃	Amminetrichloroboron	nh3bcl3
1620	SiH₃CCl₃	(trichloromethyl)silane	sih3ccl3
1621	CH₂CClCHCH₂	1,3-Butadiene, 2-chloro-	c4h5cl
1622	C₃H₅ClO	Oxirane, (chloromethyl)-	c106898
1623	CH₂FCH₂CH₂F	1,3-difluoropropane	ch2fch2ch2f
1624	CH₃CF₂CH₃	2,2-difluoropropane	ch3cf2ch3
1625	CH₂ClCH₂CH₂Cl	1,3-dichloropropane	prdicl13
1626	CH₂ClCHClCH₃	Propane, 1,2-dichloro-	prdicl12
1627	CH₃CCl₂CH₃	Propane, 2,2-dichloro-	prdicl22
1628	CHCl₂CH₂CH₃	1,1-dichloropropane	prdicl11
1629	SiCl₂(CH₃)₂	dichlorodimethylsilane	sicl2me2
1630	CH₂CClCH₂CH₃	1-Butene, 2-chloro-	bute1cl2
1631	CH₂CHCH₂CH₂Cl	1-Butene, 4-chloro-	bute1cl4
1632	CH₂CHCHClCH₃	1-Butene, 3-chloro-	bute1cl3
1633	CH₂ClCHCHCH₃	2-Butene, 1-chloro-	bute2cl1
1634	CH₃CClCHCH₃	2-Butene, 2-chloro-, (E)-	bute2cl2e
1635	CH₃CClCHCH₃	2-Butene, 2-chloro-, (Z)-	bute2cl2z
1636	CHClCHCH₂CH₃	(E)-1-Chloro-1-butene	bute1cl1
1637	CHClCHCH₂CH₃	(Z)-1-Chloro-1-butene	bute1cl1z
1638	C₄H₉F	1-fluorobutane	butaf1
1639	CH₃CHFCH₂CH₃	2-fluorobutane	butaf2
1640	CH₂ClCH₂CH₂CH₃	Butane, 1-chloro-	butacl1
1641	CH₃CCl(CH₃)CH₃	Propane, 2-chloro-2-methyl-	procl2me2
1642	CH₃CHClCH₂CH₃	Butane, 2-chloro-	butacl2
1643	XeF₄	Xenon tetrafluoride	xef4
1644	C₂H₂N₂O	Furazan	furazan
1645	CF₃PH₂	phosphine, (trifluoromethyl)-	cf3ph2
1646	NH₃BF₃	Amminetrifluoroboron	nh3bf3
1647	C₆H₂	hexatriyne	c6h2
1648	C₆H₄	(E)-Hexa-1,5-diyne-3-ene	c6h4e
1649	C₆H₄	(Z)-Hexa-1,5-diyne-3-ene	c6h4z
1650	C₆H₄	Benzyne	benzyne
1651	C₆H₅	phenyl	phenyl
1652	C₆H₅^-	phenyl anion	phenyl-
1653	C₆H₆	Prismane	prismane
1654	C₆H₆	1,2,4,5-Hexatetraene	ht1245
1655	C₆H₆	2,4-Hexadiyne	hexadiyne
1656	C₆H₆	3,4-Dimethylenecyclobutene	cb34m
1657	C₆H₆	Benzene	benzene
1658	C₆H₆	Benzvalene	bv
1659	C₆H₆	Dewar Benzene	dewar
1660	C₆H₆	Hexa-1,5-diene-3-yne	hdy153
1661	C₆H₆	Trimethylenecycopropane	tmcp
1662	C₆H₆⁺	Benzene cation	c6h6+
1663	C₆H₇⁺	benzene, protonated	c6h7+
1664	C₆H₈	(E)-hexa-1,3,5-triene	c821078
1665	C₆H₈	(E)-hexa-2,3,4-triene	c59660650
1666	C₆H₈	(Z)-hexa-1,3,5-triene	hexatri135
1667	C₆H₈	(Z)-hexa-2,3,4-triene	hetr234c
1668	C₆H₈	1,3-Cyclohexadiene	cyhexadiene13
1669	C₆H₈	1,4-Cyclohexadiene	cyhexadiene14
1670	C₆H₈	3-Methylenecyclopentene	c930267
1671	C₆H₈	Bicyclo[2.1.1]hex-2-ene	c822413
1672	C₆H₈	Bicyclo[2.2.0]hex-1(4)-ene	c30830207
1673	C₆H₈	Bicyclo[3.1.0]hex-2-ene	c694019
1674	C₆H₁₀	1,3-Hexadiene, (E)-	hexdi13e
1675	C₆H₁₀	1,3-Hexadiene, (Z)-	hexdi13z
1676	C₆H₁₀	1,4-Hexadiene, (E)-	hexdi14t
1677	C₆H₁₀	1,4-Hexadiene, (Z)-	hexdi14z
1678	C₆H₁₀	1,5-Hexadiene	c592427
1679	C₆H₁₀	1-Butyne, 3,3-dimethyl-	c917920
1680	C₆H₁₀	1-Hexyne	hexyne1
1681	C₆H₁₀	2,4-Hexadiene, (E,E)-	hexdi24ee
1682	C₆H₁₀	2,4-Hexadiene, (E,Z)-	hexdi24ez
1683	C₆H₁₀	2,4-Hexadiene, (Z,Z)-	hexdi24zz
1684	C₆H₁₀	2-Hexyne	c764352
1685	C₆H₁₀	3-Hexyne	hexyne3
1686	C₆H₁₀	cyclohexene	cyclohexene
1687	C₆H₁₀	Cyclopentene, 1-methyl-	c693890
1688	C₆H₁₀	Cyclopentene, 3-methyl-	c1120623
1689	C₆H₁₀	Cyclopentene, 4-methyl-	c1759815
1690	C₄H₆(CH₃)₂	1,1-dimethylcyclobutane	dmcb11
1691	C₆H₁₂	(1R,2R)-1,2-dimethylcyclobutane	dmcb12t
1692	C₆H₁₂	(1r,3r)-1,3-dimethylcyclobutane	dmcb13t
1693	C₆H₁₂	(E)-2-Hexene	e2hexene
1694	C₆H₁₂	(E)-3-methylpent-2-ene	c616126
1695	C₆H₁₂	(E)-hex-3-ene	e3hexene
1696	C₆H₁₂	(Z)-3-methylpent-2-ene	c922623
1697	C₆H₁₂	(Z)-hex-2-ene	z2hexene
1698	C₆H₁₂	(Z)-hex-3-ene	z3hexene
1699	C₆H₁₂	2,3-dimethylbut-1-ene	c563780
1700	C₆H₁₂	2,3-dimethyl-but-2-ene	tmeet
1701	C₆H₁₂	3-methylenepentane	c760214
1702	C₆H₁₂	cis-1,2-dimethylcyclobutane	dmcb12c
1703	C₆H₁₂	cis-1,3-dimethylcyclobutane	dmcb13c
1704	C₆H₁₂	Cyclohexane	cyclohexane
1705	C₆H₁₂	Cyclopentane, methyl-	c96377
1706	C₆H₁₂	Ethylcyclobutane	c4806615
1707	C₆H₁₂	hex-1-ene	hexene1
1708	C₆H₁₄	Butane, 2,2-dimethyl-	buta22
1709	C₆H₁₄	Butane, 2,3-dimethyl-	buta23
1710	C₆H₁₄	Hexane	hexane
1711	C₆H₁₄	Pentane, 2-methyl-	penta2
1712	C₆H₁₄	Pentane, 3-methyl-	penta3
1713	C₄N₂	2-Butynedinitrile	c4n2
1714	N₃P₃	1,3,5,2,4,6-Triazatriphosphorine	n3p3
1715	C₄H₂N₂	Fumaronitrile	c4h2n2
1716	C₂H₂N₄	sym-tetrazine	ttz
1717	C₃H₃N₃	1,3,5-Triazine	triazine135
1718	CH₃N₅	5-Aminotetrazole	c4418615
1719	C₄H₄N₂	1,3-Diazine	diazine13
1720	C₄H₄N₂	Pyrazine	pyrazine
1721	C₄H₄N₂	Pyridazine	pyridazine
1722	C₄H₄N₂	Succinonitrile	c110612
1723	C₂H₄N₄	1H-Tetrazole, 1-methyl-	c16681779
1724	C₂H₄N₄	1H-Tetrazole, 5-methyl-	c4076362
1725	C₂H₄N₄	2H-Tetrazole, 2-methyl-	c16681780
1726	C₅H₅N	Bicyclo[1.1.0]butane-1-carbonitrile	bibucn
1727	C₅H₅N	E-2,4-pentadienenitrile	bdcn
1728	C₅H₅N	Pyridine	pyridine
1729	B₃N₃H₆	borazine	borazine
1730	C₆H₆	Fulvene	fulvene
1731	C₅H₆N⁺	Pyridinium	c5h6n
1732	C₄H₆N₂	1H-Imidazole, 2-methyl-	c693981
1733	C₅H₇N	(E)-2-Pentenenitrile	c26294984
1734	C₅H₇N	(E)-3-Pentenenitrile	c16529661
1735	C₅H₇N	(Z)-2-Pentenenitrile	c25899507
1736	C₅H₇N	1H-Pyrrole, 1-methyl-	c96548
1737	C₅H₇N	Cyclobutanecarbonitrile	c4426113
1738	C₅H₉N	1,2,3,6-Tetrahydropyridine	c694053
1739	C₅H₉N	Butanenitrile, 2-methyl-	c18936179
1740	C₅H₉N	Pentanenitrile	c110598
1741	C₅H₉N	Propanenitrile, 2,2-dimethyl-	c630182
1742	C₆H₁₀	Bicyclo[3.1.0]hexane	c285585
1743	C₅H₁₁N	Cyclopentanamine	cypentam
1744	C₅H₁₁N	Piperidine	piper
1745	C₄H₁₂N₂	1,2-Butanediamine	c4426486
1746	C₄H₁₂N₂	2-Methyl-1,2-propanediamine	c811938
1747	Li₂CO₃	Lithium Carbonate	li2co3
1748	Na₂CO₃	Sodium Carbonate	na2co3
1749	C₂O₄^--	oxalate anion	c2o4
1750	MgSO₄	Magnesium Sulfate	mgso4
1751	N₂O₄	Dinitrogen tetroxide	n2o4
1752	C₃H₂O₃	vinylene carbonate	vica
1753	C₂H₂O₄	Oxalic Acid	oxalic
1754	C₂H₃NO₃	Oxamic acid	oxamic
1755	C₄H₄O₂	2(5H)-Furanone	furanone
1756	C₄H₄O₂	2-Oxetanone, 4-methylene-	c674828
1757	C₂H₄N₂O₂	Oxalamide	oxalamide
1758	C₂H₄N₂S₂	Ethanedithioamide	c79403
1759	C₂H₄CO₃	Ethylene carbonate	etco3
1760	C₃H₄O₂S	2H-Thiete-1,1-dioxide	c7285327
1761	C₃H₄S₃	1,3-Dithiolane-2-thione	c822388
1762	C₂H₄O₄	Formic acid dimer	fadimer
1763	C₄H₅NO	3-Methylisoxazole	isox3m
1764	C₄H₅NO	Isoxazole, 5-methyl-	c5765446
1765	C₄H₅NS	4-Methylthiazole	c693958
1766	C₂H₅NO₃	Nitric acid, ethyl ester	c625581
1767	C₅H₆O	2H-Pyran	pyran2
1768	C₅H₆O	2-methylfuran	furan2m
1769	C₅H₆O	3-Methylfuran	furan3m
1770	C₅H₆O	Pentadienal	pdal
1771	C₅H₆S	Thiophene, 2-methyl-	c554143
1772	C₅H₆S	Thiophene, 3-methyl-	c616444
1773	C₄H₆O₂	γ–Butyrolactone	c96480
1774	C₄H₆O₂	2,3-Butanedione	c431038
1775	C₄H₆O₂	2-Propenoic acid, methyl ester	c96333
1776	C₄H₆O₂	Crotonic Acid	crot
1777	C₄H₆OS	2,3-dihydrothiophene-2-ol	c9000117
1778	C₄H₆OS	2,5-dihydrothiophene-3-ol	c9000093
1779	C₄H₆OS	4,5-dihydrothiophene-2-ol	c9000106
1780	C₄H₆OS	4,5-dihydrothiophene-3-ol	c9000082
1781	C₄H₆OS	Dihydro-2-(3H)-thiophenone	c1003107
1782	C₄H₆OS	Dihydro-3-(2H)-thiophenone	c1003049
1783	C₄H₆OS	Vinyl sulfoxide	c1115157
1784	CH₆N₄S	Carbonothioic dihydrazide	thiacarb
1785	C₂H₆N₂O₂	(E)-Azodioxymethane	c37765154
1786	C₂H₆N₂O₂	Dimethylnitroamine	c4164287
1787	C₃H₆O₃	1,3,5-Trioxane	trioxane
1788	C₃H₆S₃	1,3,5-Trithiane	c3h6s3
1789	C₃H₆S₃	Carbonotrithioic acid, dimethyl ester	c2314489
1790	C₂H₆O₃S	Sulfurous acid, dimethyl ester	c616422
1791	C₄H₇NO	2-Pyrrolidinone	c616455
1792	C₄H₇NO	Ethoxyacetonitrile	etoaccn
1793	C₄H₇NO	Methacrylamide	c79390
1794	C₄H₇NO	Oxazole, 4,5-dihydro-2-methyl-	c1120645
1795	HCONH₂CN₂H₄	formamide aminomethanimine dimer	d13
1796	C₃H₇ONO	Propyl nitrite	prono
1797	CH₃CH(CH₃)ONO	Isopropyl nitrite	c541424
1798	CH₃CH(NH₂)COOH	Alanine	alanine
1799	CH₃NHCH₂COOH	Sarcosine	sarcosine
1800	NH₂CH₂CH₂COOH	β–alanine	betaalanine
1801	NH₂COOC₂H₅	Urethane	urethane
1802	C₅H₈O	2H-Pyran, 3,4-dihydro-	c110872
1803	C₅H₈O	Cyclopentanone	c120923
1804	C₅H₈O	Furan, 2,3-dihydro-5-methyl-	c1487156
1805	C₅H₈O	Methyl cyclopropyl ketone	c765435
1806	N(CH₃)₂CONH₂	Urea, N,N-dimethyl-	c598947
1807	NH(CH₃)CONH(CH₃)	Urea, N,N'-dimethyl-	c96311
1808	NH₂CONHC₂H₅	Urea, ethyl-	c625525
1809	C₄H₈O₂	1,3-Dioxane	dioxan13
1810	C₄H₈O₂	1,3-Dioxolane, 2-methyl-	c497267
1811	C₄H₈O₂	1,4-Dioxane	dioxan14
1812	C₄H₈O₂	Ethene, 1,1-dimethoxy-	c922690
1813	C₄H₈O₂	Ethyl acetate	c141786
1814	C₄H₈OS	s-Ethyl thioacetate	c625605
1815	C₃H₈O₃	1,2,3-Propanetriol	glycerin
1816	C₃H₈O₂S	(Methylsulfonyl)ethane	c594434
1817	C₄H₉NO	Butanamide	c541355
1818	C₄H₉NO	Propanamide, 2-methyl-	c563837
1819	C₅H₁₀O	2-Butanone, 3-methyl-	c563804
1820	C₅H₁₀O	2H-Pyran, tetrahydro-	c142687
1821	C₅H₁₀O	2-methylbutyraldehyde	2meba
1822	C₅H₁₀O	2-Pentanone	mpk
1823	C₅H₁₀O	3-Pentanone	dek
1824	C₅H₁₀O	Cyclopentanol	c96413
1825	C₅H₁₀O	Oxetane, 3,3-dimethyl-	c6921353
1826	C₅H₁₀O	Pentanal	pal
1827	C₅H₁₀S	2H-Thiopyran, tetrahydro-	c1613510
1828	C₅H₁₀S	3-Ethylthio-1-propene	c5296628
1829	C₅H₁₀S	Cyclopentanethiol	c1679078
1830	C₅H₁₀S	Thiophene, tetrahydro-2-methyl-	c1795091
1831	C₅H₁₀S	Thiophene, tetrahydro-3-methyl-	c4740005
1832	C₄H₁₀O₂	1,1-Dimethoxyethane	c534156
1833	C₄H₁₀O₂	1,3-Butanediol	budiol13
1834	C₄H₁₀O₂	1,4-Butanediol	budiol14
1835	C₄H₁₀O₂	Ethane, 1,2-dimethoxy-	c110714
1836	C₄H₁₀OS	Diethyl sulfoxide	c70291
1837	C₄H₁₀S₂	1,4-Butanedithiol	budisl14
1838	C₄H₁₁NO	Diethylhydroxylamine	c3710847
1839	C₅H₁₂O	1-Butanol, 2-methyl-	c137326
1840	C₅H₁₂O	1-Butanol, 3-methyl-	c123513
1841	C₅H₁₂O	1-Pentanol	pentanol1
1842	C₅H₁₂O	2-Butanol, 3-methyl-	c598754
1843	C₅H₁₂O	2-Pentanol	peol2
1844	C₅H₁₂O	3-Pentanol	pentan3ol
1845	C₅H₁₂O	Butane, 1-methoxy-	meobu
1846	C₅H₁₂O	Propane, 1-ethoxy-	proet
1847	C₅H₁₂O	Propane, 2-methoxy-2-methyl-	c1634044
1848	C₅H₁₂S	1-Butanethiol, 2-methyl-	c1878188
1849	C₅H₁₂S	1-Butanethiol, 3-methyl-	c541311
1850	C₅H₁₂S	1-Pentanethiol	c110667
1851	C₅H₁₂S	1-Propanethiol, 2,2-dimethyl-	c1679089
1852	C₅H₁₂S	2-Butanethiol, 2-methyl-	c1679090
1853	C₅H₁₂S	2-Butanethiol, 3-methyl-	c2084186
1854	C₅H₁₂S	Butane, 1-(methylthio)-	c628295
1855	C₅H₁₂S	Ethyl propyl sulfide	c4110503
1856	C₅H₁₂S	Propane, 2-(ethylthio)-	c5145993
1857	C₅H₁₂S	Propane, 2-methyl-2-(methylthio)-	c6163640
1858	C₄F₂	difluorobutadiyne	c4f2
1859	ClCOClCO	Oxalyl chloride	oxcl
1860	CF₃CN	Acetonitrile, trifluoro-	cf3cn
1861	CF₃CN⁺	Acetonitrile, trifluoro- cation	cf3cn+
1862	B₂F₄	Diboron tetrafluoride	b2f4
1863	B₂Cl₄	Diboron tetrachloride	b2cl4
1864	C₂F₄	Tetrafluoroethylene	c2f4
1865	C₂F₄⁺	Tetrafluoroethylene cation	c2f4+
1866	C₂ClF₃	Ethene, chlorotrifluoro-	c2f3cl
1867	CF₂CCl₂	difluorodichloroethylene	cf2ccl2
1868	CFClCClF	trans-1,2-dichloro-1,2-difluoroethylene	cfclcclf
1869	CFClCFCl	cis-1,2-dichloro-1,2-difluoroethylene	cfclcfcl
1870	C₂FCl₃	fluorotrichloroethene	c2fcl3
1871	C₂Cl₄	Tetrachloroethylene	c2cl4
1872	C₂Br₄	tetrabromoethene	c2br4
1873	CF₃OF	Trifluoromethylhypofluorite	cf3of
1874	SiF₅^-	silicon pentafluoride anion	sif5-
1875	SOF₄	Sulfur tetrafluoride oxide	sof4
1876	PF₅	Phosphorus pentafluoride	pf5
1877	AsF₅	Arsenic pentafluoride	asf5
1878	PCl₅	Phosphorus pentachloride	pcl5
1879	SF₅	Sulfur pentafluoride	sf5
1880	SF₅⁺	pentafluoro sulfur cation	sf5+
1881	SbCl₅	Antimony pentachloride	sbcl5
1882	BrF₅	bromine pentafluoride	brf5
1883	ClF₅	chlorinepentafluoride	clf5
1884	IF₅	pentafluoroiodine	if5
1885	CF₃CHO	trifluoroacetaldehyde	cf3cho
1886	CCl₃CHO	trichloroacetaldehyde	ccl3cho
1887	CHFClCHClF	ethane, 1,2-dichloro-1,2-difluoro-	chfclchclf
1888	CF₃CH₂F	1,1,1,2-tetrafluoroethane	cf3ch2f
1889	CHF₂CHF₂	1,1,2,2-tetrafluoroethane	chf2chf2
1890	CF₃CH₂Cl	2,2,2-Trifluoroethyl chloride	cf3ch2cl
1891	CHFClCHFCl	1,2-dichloro-1,2-difluoroethane RR	chfclchfcl
1892	CH₂ClCCl₃	1,1,1,2-tetrachloroethane	ch2clccl3
1893	CHCl₂CHCl₂	Ethane, 1,1,2,2-tetrachloro-	chcl2chcl2
1894	CH₂BrCBr₃	1,1,1,2-tetrabromo ethane	c2h2br4
1895	CHCl₂CHF₂	1,1-dichloro-2,2-difluoroethane	c2h2cl2f2
1896	CF₃COOH	trifluoroacetic acid	cf3cooh
1897	C₄H₃ClO	Furan, 2-chloro	fur2cl
1898	C₄H₃ClO	Furan,3-chloro	fur3cl
1899	C₃H₅ClO₂	Carbonochloridic acid, ethyl ester	c541413
1900	C₃H₅Cl₃	Propane, 1,2,3-trichloro-	prcl135
1901	C₄H₈Cl₂	1,4-Dichlorobutane	c110565
1902	C₄H₈Cl₂	Butane, 1,2-dichloro-	c616217
1903	C₄H₈Cl₂	Butane, 1,3-dichloro-	c1190223
1904	C₄H₈Cl₂	Butane, 2,3-dichloro-, (r,r)-(.+/-.)-	c2211678
1905	C₄H₈Cl₂	Butane, 2,3-dichloro-, (r,s)-	c4028562
1906	C₄H₉ClO	1-Chloro-2-ethoxyethane	c628342
1907	C₅H₁₁Cl	Pentane, 1-chloro-	pencl1
1908	C₄H₈O₂	Butanoic acid	bua
1909	C₆H₅CH₂	benzyl radical	benzyl
1910	C₇H₇	cycloheptatrienyl radical	c7h7
1911	C₇H₇⁺	cycloheptatrienyl cation	c7h7+
1912	C₆H₅CH₃	toluene	toluene
1913	C₇H₈	cycloheptatriene	cht
1914	C₇H₈	Norbornadiene	norbor
1915	C₇H₈	Quadricyclane	qucy
1916	C₇H₁₂	Norbornane	nor
1917	C₇H₁₄	cycloheptane	c7h14
1918	C₇H₁₆	2-methylhexane	2mhex
1919	C₇H₁₆	3-methylhexane	hex3m
1920	C₇H₁₆	heptane	heptane
1921	CH(CN)₃	tricyanomethane	mecn3
1922	HN=C=C(CN)₂	Dicyanoketenimine	c4hn3
1923	C₆H₇N	2-Methylpyridine	mp
1924	C₆H₅NH₂	aniline	aniline
1925	C₆H₁₃N	2-Methylpiperidine	pip2m
1926	C₆H₁₃N	cyclohexanamine	cham
1927	C₆H₁₅N	triethylamine	tea
1928	N₂O₅	Dinitrogen pentoxide	n2o5
1929	C₄H₂O₃	Maleic Anhydride	malan
1930	C₅H₄O₂	4-Cyclopentene-1,3-dione	cpdio
1931	C₅H₄O₂	furfural	furfural
1932	C₆H₅O	phenoxy radical	phenoxy
1933	C₅H₅NO	2(1H)-Pyridinone	c72762006
1934	C₅H₅NO	2(3H)-Pyridinone	c9000048
1935	C₅H₅NO	2(5H)-Pyridinone	c9000037
1936	C₅H₅NO	2-Pyridinol	c109104
1937	C₅H₅NO	3(2H)-Pyridinone	c9000004
1938	C₅H₅NO	3(4H)-Pyridinone	c9000026
1939	C₅H₅NO	3(6H)-Pyridinone	c9000015
1940	C₅H₅NO	3-Pyridinol	c109002
1941	C₅H₅NO	4(1H)-Pryidinone	c9000060
1942	C₅H₅NO	4(3H)-Pryidinone	c9000059
1943	C₅H₅NO	4-Pyridinol	c626642
1944	C₆H₅OH	phenol	phenol
1945	C₆H₆O	2,4-Cyclohexadienone	c24599573
1946	C₆H₆O	2,5-Cyclohexadienone	c5664335
1947	C₆H₅SH	Benzenethiol	phsh
1948	HO₂CCHNH₂CH₂OH	Serine	serine
1949	C₅H₈O₂	Acetylacetone	acac
1950	C₄H₈O₂S	Sulfolane	sulfolane
1951	C₇H₁₀	Norbornene	norbornene
1952	CH(C₂H₃)₃	trivinyl methane	tvm
1953	C₆H₁₀O	cyclohexanone	chexo
1954	C₆H₁₂O	hexanal	c6h12o
1955	C₆H₁₂O	Oxepane	oxepane
1956	C₃H₇OC₃H₇	di-n-propyl ether	propr
1957	F₂CCCF₂	tetrafluoroallene	pfa
1958	CF₃COO^-	trifluoro acetate anion	cf3coo-
1959	CF₃COF	trifluoroacetyl fluoride	cf3cof
1960	CF₃COCl	trifluoroacetyl chloride	cf3cocl
1961	PF₆	Hexafluorophosphate neutral	pf6
1962	PF₆^-	Hexafluorophosphate ion	pf6-
1963	SF₆	Sulfur Hexafluoride	sf6
1964	SeF₆	Selenium hexafluoride	sef6
1965	SF₅Cl	sulfur chloropentafluoride	sf5cl
1966	CF₃CHF₂	pentafluoroethane	cf3chf2
1967	CF₃CHFCl	1,1,1,2-tetrafluorochloroethane	cf3chfcl
1968	CF₃CHCl₂	1,1-Dichloro-2,2,2-trifluoroethane	cf3chcl2
1969	CHCl₂CClF₂	Ethane, 1,2,2-trichloro-1,1-difluoro-	chcl2cclf2
1970	CCl₃CHCl₂	pentachloroethane	ccl3chcl2
1971	C₆H₅F	Fluorobenzene	bzf
1972	C₆H₅Cl	chlorobenzene	bzcl
1973	C₆H₅Br	bromobenzene	bzbr
1974	C₈H₆	Calicene	calicene
1975	C₆H₅CCH	phenylacetylene	phac
1976	C₈H₆	benzocyclobutadiene	bcbd
1977	C₈H₆	Pentalene	pentalene
1978	C₆H₅CHCH₂	Styrene	styrene
1979	C₈H₈	cubane	cubane
1980	C₈H₈	cyclooctatetraene	cot
1981	C₆H₅CH₂CH₃	Ethylbenzene	etbz
1982	CH₃C₆H₄CH₃	meta-xylene	mxylene
1983	CH₃C₆H₄CH₃	paraxylene	pxylene
1984	C₈H₁₄	Bicyclo[2.2.2]octane	bico222
1985	C₈H₁₆	cyclooctane	cyclooct
1986	(CH₃)₃CC(CH₃)₃	tetramethylbutane	tmb
1987	C₈H₁₈	Octane	c8h18
1988	C₆H₅CN	phenyl cyanide	phcn
1989	C₆H₁₂N₂	Triethylenediamine	ted
1990	C₄O₄^--	squarate dianion	c4o4--
1991	S₄N₄	Tetrasulfur tetranitride	s4n4
1992	S₈	Octasulfur	s8
1993	C₆H₄O₂	parabenzoquinone	pbq
1994	C₄H₄N₂O₂	Uracil	uracil
1995	C₆H₅CHO	benzaldehyde	benzal
1996	C₆H₅OCH₃	Anisole	anisole
1997	C₅H₉NO₂	Proline	proline
1998	C₆H₁₂O₂	Methyl pivalate	c598981
1999	C₆H₁₂O₂	Hexanoic acid	hexa
2000	C₄F₄	tetrafluorcyclobutadiene	c4f4
2001	Al₂Cl₆	Aluminum, di-μ-chlorotetrachlorodi-	al2cl6
2002	CF₃CF₂Cl	pentafluorochloroethane	cf3cf2cl
2003	CF₂ClCF₂Cl	1,2-Dichloro-1,1,2,2-tetrafluoroethane	cf2clcf2cl
2004	CF₃CFCl₂	1,1-Dichlorotetrafluoroethane	cf3cfcl2
2005	CF₂ClCFCl₂	Ethane, 1,1,2-trichloro-1,2,2-trifluoro-	cf2clcfcl2
2006	CF₃CCl₃	1,1,1-trifluoro-2,2,2-trichloroethane	cf3ccl3
2007	C₂F₆	hexafluoroethane	c2f6
2008	C₂Cl₆	hexachloroethane	c2cl6
2009	IF₇	Iodine heptafluoride	if7
2010	C₆H₄F₂	metadifluorobenzene	mdfb
2011	C₆H₄F₂	orthodifluorobenzene	odfb
2012	C₆H₄F₂	1,4-difluorobenzene	pdfb
2013	C₆H₄Cl₂	1,2-dichlorobenzene	dcb12
2014	C₆H₄Cl₂	1,3-dichlorobenzene	dcb13
2015	C₆H₄Cl₂	1,4-dichlorobenzene	dcb14
2016	C₆H₅NO	nitrosobenzene	bzno
2017	C₉H₈	Indene	indene
2018	C₉H₈	spiro[4.4]nona-1,3,6,8-tetraene	snt
2019	C₉H₁₂	n-propyl benzene	prbz
2020	C₉H₂₀	Nonane	nonane
2021	C(CN)₄	tetracyanomethane	c5n4
2022	C₅H₄N₄	purine	purine
2023	C₈H₇N	Indole	indole
2024	C₃H₃N₃O₃	cyanuric acid	cyanuric
2025	C₆H₅NO₂	Nitrobenzene	c6h5no2
2026	C₆H₅COOH	benzoic acid	benzo
2027	CH₃COC₆H₅	acetophenone	acph
2028	C₃Cl₃N₃	1,3,5-Triazine, 2,4,6-trichloro-	c3cl3n3
2029	C₃F₆	hexafluoropropene	c3f6
2030	C₆H₃F₃	Benzene trifluoride 123	bzf3a
2031	C₈H₁₈O	1-Octanol	octanol
2032	C₁₀H₈	Azulene	azu
2033	C₁₀H₈	naphthalene	naph
2034	C₁₀H₁₀	bullvalene	bullv
2035	C₁₀H₁₆	adamantane	adamantane
2036	C₆N₄	Tetracyanoethylene	tcne
2037	C₆N₄^-	tetracyanoethylene anion	tcne-
2038	C₁₀H₂₂	Decane	decane
2039	C₄F₆	perfluorobutadiene	c4f6
2040	SF₅CF₃	Sulfur, pentafluoro(trifluoromethyl)-	sf5cf3
2041	C₃F₈	perfluoropropane	c3f8
2042	Fe(CO)₅	Iron pentacarbonyl	ipc
2043	Fe(C₅H₅)₂	ferrocene	fecp2
2044	B₁₂H₁₂^--	Dodecahydrododecaborate(2-)	b12h12--
2045	B₁₂H₁₂^--	Dodecahydrododecaborate(2-)	b12h12--
2046	C₁₂H₈	Acenaphthylene	acenaph
2047	C₁₂H₈	biphenylene	biph
2048	C₁₂H₁₀	biphenyl	biphenyl
2049	C₁₂H₁₀	Heptalene	heptalene
2050	C₆H₁₂O₆	Inositol	inositol
2051	C₆F₆	hexafluorobenzene	c6f6
2052	S₂F₁₀	disulphur decafluoride	s2f10
2053	C₁₃H₁₀	Fluorene	fluorene
2054	C₁₄H₁₀	Anthracene	anth
2055	C₁₄H₁₀	Phenanthrene	phenanthrene
2056	C₁₄H₁₄	Bibenzyl	bibenzyl
2057	C₁₂H₁₀N₂	azobenzene	azobenzene
2058	C₆H₅COC₆H₅	benzophenone	benzophenone
2059	C₁₆H₁₀	Pyrene	pyrene
2060	C₁₈H₁₂	Tetracene	tetracene
2061	C₁₉H₁₆	Triphenylmethane	tpm
2062	C₂₄H₁₂	Coronene	coronene
2063	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