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

List of which calculations are completed at QCISD(T)=FULL /aug-cc-pV(T+d)Z

count	Species	Name	State	Conformation
1	SiH₃	Silyl radical	²A₁	C_3v
2	SiH₄	Silane	¹A₁	T_d
3	PH₃	Phosphine	¹A₁	C_3v
4	PH₄⁺	phosphonium cation
5	H₂S⁺	Hydrogen sulfide cation	²B₁	C_2v
6	H₃S⁺	Sulfonium cation	¹A₁	C_3v
7	HCl	Hydrogen chloride	¹Σ	C_∞v
8	BAl	Boron Aluminum	³Σ	C_∞v
9	AlC	Aluminum carbide	⁴Σ	C_∞v
10	Si₂H₆	disilane	¹E_u	D_3d
11	NaS	Sodium sulfide	²Π	C_∞v
12	SiO	Silicon monoxide	¹Σ	C_∞v
13	SiS	silicon monosulfide	¹Σ	C_∞v
14	GeO	Germanium monoxide	¹Σ	C_∞v
15	NS	Mononitrogen monosulfide	²Π	C_∞v
16	PO	Phosphorus monoxide	²Π	C_∞v
17	SO	Sulfur monoxide	³Σ	C_∞v
18	SO	Sulfur monoxide	¹Σ	C_∞v
19	HBS	hydrogen boron sulfide	¹Σ	C_∞v
20	H₂CS	Thioformaldehyde	¹A₁	C_2v
21	H₂S₂	Disulfane	¹A	C₂
22	H₂S₂⁺	hydrogen disulfide cation	²B_g	C_2h
23	CH₃SH	Methanethiol	¹A^'	C_s
24	CH₃SH₂⁺	protonated methylsulfide	¹A^'	C_s
25	LiCl	lithium chloride	¹Σ	C_∞v
26	AlF	Aluminum monofluoride	¹Σ⁺	C_∞v
27	GeCl⁺	Germanium monochloride cation
28	NCl	nitrogen monochloride	³Σ	C_∞v
29	SCl	sulfur monochloride	²Π	C_∞v
30	SCl⁺	sulfur monochloride cation	³Σ_g	C_∞v
31	Cl₂⁺	chlorine diatomic cation	²Π_g	D_∞h
32	CH₃Cl	Methyl chloride	¹A₁	C_3v
33	SiH₃F	monofluorosilane	¹A₁	C_3v
34	SiH₃Cl	chlorosilane	¹A₁	C₁
35	Si₃H₈	trisilane
36	Na₂S	Sodium sulfide
37	Na₂S	Sodium sulfide
38	OCS	Carbonyl sulfide	¹Σ	C_∞v
39	SO₂	Sulfur dioxide	¹A₁	C_2v
40	CH₂CS	Thioketene
41	ClNO	Nitrosyl chloride	¹A^'	C_s
42	OPCl	Phosphorus oxychloride
43	SiF₂	Silicon difluoride	¹A₁	C_2v
44	OClO	Chlorine dioxide	²B₁	D_∞h
45	ClSO	Sulfur chloride oxide	²A^"	C_s
46	FClO	chlorosyl fluoride	¹A^'	C_s
47	ClOF	Chlorine hypofluorite	¹A^'	C_s
48	SF₂	sulfur difluoride	¹A₁	C_2v
49	SiH₂F₂	difluorosilane
50	SiH₂Cl₂	dichlorosilane	¹A₁	C_2v
51	S₂N₂	Disulfur dinitride	¹A_G	D_2h
52	SO₃	Sulfur trioxide	¹A₁^'	D_3h
53	ClO₂F	Chloryl fluoride	¹A^'	C_s
54	ClF₃	Chlorine trifluoride	¹A₁	C_2v
55	SiHF₃	trifluorosilane
56	SiF₅^-	silicon pentafluoride anion

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	nah
35	NaH^-	sodium hydride anion	nah-
36	NaH⁺	sodium hydride cation	nah+
37	KH	Potassium hydride	kh
38	KH⁺	Potassium hydrogen cation	kh+
39	CuH	Copper monohydride	cuh
40	Be	Beryllium atom	be
41	Be^-	Beryllium atom anion	be-
42	Be⁺	Beryllium atom cation	be+
43	Mg	Magnesium atom	mg
44	Mg^-	Magnesium atom anion	mg-
45	Mg⁺	Magnesium atom cation	mg+
46	Ca	Calcium atom	ca
47	Ca^-	Calcium atom anion	ca-
48	Ca⁺	Calcium atom cation	ca+
49	Zn	Zinc atom	zn
50	Zn^-	Zinc atom anion	zn-
51	Zn⁺	Zinc atom cation	zn+
52	BeH	beryllium monohydride	beh
53	BeH^-	berylium monohydride anion	beh-
54	BeH⁺	beryllium monohydride cation	beh+
55	MgH	magnesium monohydride	mgh
56	MgH^-	magnesium monohydride anion	mgh-
57	MgH⁺	magnesium monohydride cation	mgh+
58	CaH	Calcium monohydride	cah
59	CaH⁺	Calcium monohydride cation	cah+
60	TiH	Titanium monohydride	tih
61	ZnH	Zinc monohydride	znh
62	ZnH⁺	Zinc, protonated	znh+
63	BeH₂	beryllium dihydride	beh2
64	BeH₂⁺	Beryllium dihydride cation	beh2+
65	MgH₂	magnesium dihydride	mgh2
66	CaH₂	Calcium Hydride	cah2
67	ZnH₂	Zinc hydride	znh2
68	B	Boron atom	b
69	B^-	Boron atom anion	b-
70	B⁺	Boron atom cation	b+
71	Al	Aluminum atom	al
72	Al^-	Aluminum atom anion	al-
73	Al⁺	Aluminum atom cation	al+
74	Sc	Scandium atom	sc
75	Sc⁺	Scandium cation	sc+
76	Ga	Gallium atom	ga
77	Ga^-	Gallium atom anion	ga-
78	Ga⁺	Gallium atom cation	ga+
79	BH	Boron monohydride	bh
80	BH^-	boron monohydride anion	bh-
81	BH⁺	boron monohydride cation	bh+
82	AlH	aluminum monohydride	alh
83	AlH^-	aluminum monohydride anion	alh-
84	AlH⁺	aluminum monohydride cation	alh+
85	ScH	Scandium monohydride	sch
86	ScH⁺	Scandium monohydride cation	sch+
87	GaH	Gallium monohydride	gah
88	GaH⁺	Gallium monohydride cation	gah+
89	BH₂	boron dihydride	bh2
90	BH₂^-	boron dihydride anion	bh2-
91	BH₂⁺	Boron dihydride cation	bh2+
92	AlH₂	aluminum dihydride	alh2
93	AlH₂^-	aluminum dihydride anion	alh2-
94	AlH₂⁺	aluminum dihydride cation	alh2+
95	BH₃	boron trihydride	bh3
96	BH₃^-	boron trihydride anion	bh3-
97	BH₃⁺	boron trihydride cation	bh3+
98	AlH₃	aluminum trihydride	alh3
99	AlH₃^-	aluminum trihydride anion	alh3-
100	AlH₃⁺	aluminum trihydride cation	alh3+
101	ScH₃	Scandium trihydride	sch3
102	GaH₃	Gallium trihydride	gah3
103	BH₄	borohydride	bh4
104	BH₄^-	borohydride anion	bh4-
105	AlH₄^-	Aluminum tetrahydride anion	alh4-
106	C	Carbon atom	c
107	C^-	Carbon atom anion	c-
108	C⁺	Carbon atom cation	c+
109	Si	Silicon atom	si
110	Si^-	Silicon atom anion	si-
111	Si⁺	Silicon atom cation	si+
112	Ti	Titanium atom	ti
113	Ti^-	Titanium atom anion	ti-
114	Ti⁺	Titanium atom cation	ti+
115	Ge	Germanium atom	ge
116	Ge^-	Germanium anion	ge-
117	Ge⁺	Germanium cation	ge+
118	Sn	Tin atom	sn
119	Sn⁺	Tin cation	sn+
120	CH	Methylidyne	ch
121	CH^-	methylidyne anion	ch-
122	CH⁺	Methylidyne cation	ch+
123	SiH	Silylidyne	sih
124	SiH^-	silicon monohydride anion	sih-
125	SiH⁺	silicon monohydride cation	sih+
126	GeH	germylidene	geh
127	GeH⁺	Germaniun monohyrdide cation	geh+
128	CH₂	Methylene	ch2
129	CH₂^-	methylene anion	ch2-
130	CH₂⁺	methylene cation	ch2+
131	SiH₂	silicon dihydride	sih2
132	SiH₂^-	silicon dihydride anion	sih2-
133	SiH₂⁺	silicon dihydride cation	sih2+
134	GeH₂	germylene	geh2
135	GeH₂^-	germylene anion	geh2-
136	CH₃	Methyl radical	ch3
137	CH₃^-	methyl anion	ch3-
138	CH₃⁺	methyl cation	ch3+
139	SiH₃^-	Silyl anion	sih3-
140	SiH₃⁺	Silyl cation	sih3+
141	GeH₃	Germyl radical	geh3
142	GeH₃⁺	germyl cation	geh3+
143	CD₄	methane-d4	cd4
144	CH₂D₂	methane-d2	ch2d2
145	CH₃D	methane-d	ch3d
146	CH₄	Methane	ch4
147	CH₄^-	Methane anion	ch4-
148	CH₄⁺	Methane cation	ch4+
149	CHD₃	methane-d3	chd3
150	SiH₂D₂	silane-d2	sih2d2
151	SiH₄⁺	Silane cation	sih4+
152	GeH₄	Germane	geh4
153	SnH₄	Stannane	snh4
154	SiH₅⁺	Silane, protonated	sih5+
155	N	Nitrogen atom	n
156	N^-	Nitrogen atom anion	n-
157	N⁺	Nitrogen atom cation	n+
158	P	Phosphorus atom	p
159	P^-	Phosphorus atom anion	p-
160	P⁺	Phosphorus atom cation	p+
161	V	Vanadium atom	v
162	V⁺	Vanadium atom cation	v+
163	As	Arsenic atomic	as
164	As^-	Arsenic anion	as-
165	As⁺	Arsenic cation	as+
166	Sb	Antimony atom	sb
167	NH	Imidogen	nh
168	NH^-	Imidogen anion	nh-
169	NH⁺	imidogen cation	nh+
170	PH	phosphorus monohydride	ph
171	PH^-	phosphorus monohydride anion	ph-
172	PH⁺	phosphorus monohydride cation	ph+
173	AsH	Arsenic monohydride	ash
174	AsH⁺	Arsenic monohydride cation	ash+
175	SbH	Antimony monohydride	sbh
176	ND₂	Amidogen-d2	nd2
177	NH₂	Amino radical	nh2
178	NH₂^-	amino anion	nh2-
179	NH₂⁺	Amino cation	nh2+
180	PH₂	Phosphino radical	ph2
181	PH₂^-	Phosphino anion	ph2-
182	PH₂⁺	Phosphino cation	ph2+
183	AsH₂	Arsenic dihydride	ash2
184	AsH₂⁺	Arsenic dihydride cation	ash2+
185	ND₃	Ammonia-d3	nd3
186	NH₃	Ammonia	nh3
187	NH₃^-	Ammonia anion	nh3-
188	NH₃⁺	ammonia cation	nh3+
189	PH₃⁺	Phosphine cation	ph3+
190	AsH₃	Arsine	ash3
191	AsH₃⁺	Arsine cation	ash3+
192	SbH₃	Stibine	sbh3
193	AsH₄⁺	Arsonium	ash4+
194	NH₄	Ammonium radical	nh4
195	NH₄⁺	ammonium cation	nh4+
196	PH₄	Phosphoranyl radical	ph4
197	O	Oxygen atom	o
198	O^-	Oxygen atom anion	o-
199	O⁺	Oxygen atom cation	o+
200	S	Sulfur atom	s
201	S^-	Sulfur atom anion	s-
202	S⁺	Sulfur atom cation	s+
203	Cr	Chromium atom	cr
204	Se	Selenium atom	se
205	Se^-	Selenium atom anion	se-
206	Se⁺	Selenium atom cation	se+
207	Te	Tellurium atom	te
208	Te⁺	Tellurium atom cation	te+
209	DO	Hydroxyl-d	od
210	OH	Hydroxyl radical	oh
211	OH^-	hydroxide anion	oh-
212	OH⁺	hydoxyl cation	oh+
213	DS	Mercapto-d	ds
214	HS	Mercapto radical	hs
215	HS^-	mercapto anion	sh-
216	HS⁺	sulfur monohydride cation	sh+
217	CrH	Chromium hydride	crh
218	CrH⁺	Chromium hydride cation	crh+
219	HSe	Selenium monohydride	hse
220	HSe^-	selenium monohydride anion	hse-
221	HSe⁺	selenium monohydride cation	hse+
222	TeH	Telluryl radical	teh
223	D₂O	Deuterium oxide	d2o
224	H₂O	Water	h2o
225	H₂O^-	water anion	h2o-
226	H₂O⁺	water cation	h2o+
227	HDO	Water-d1	hdo
228	D₂S	Hydrogen sulfide-d2	d2s
229	H₂S	Hydrogen sulfide	h2s
230	H₂S^-	Hydrogen sulfide anion	h2s-
231	H₂Se	Hydrogen selenide	h2se
232	H₂Se⁺	Hydrogen selenide cation	h2se+
233	H₂Te	Hydrogen Telluride	h2te
234	H₃O⁺	hydronium cation	h3o+
235	H₃Se⁺	Hydrogen Selenide, protonated	h3se+
236	F	Fluorine atom	f
237	F^-	Fluorine atom anion	f-
238	F⁺	Fluorine atom cation	f+
239	Cl	Chlorine atom	cl
240	Cl^-	Chlorine atom anion	cl-
241	Cl⁺	Chlorine atom cation	cl+
242	Mn	Manganese atom	mn
243	Br	Bromine atom	br
244	Br^-	Bromine atom anion	br-
245	Br⁺	Bromine atom cation	br+
246	I	Iodine atom	iodine
247	I^-	Iodine atom anion	iodine-
248	I⁺	Iodine atom cation	iodine+
249	DF	Hydrofluoric acid-d	df
250	HF	Hydrogen fluoride	hf
251	HF^-	hydrogen fluoride anion	hf-
252	HF⁺	hydrogen fluoride cation	hf+
253	DCl	Hydrochloric acid-d	dcl
254	HCl^-	hydrogen chloride anion	hcl-
255	HCl⁺	hydrogen chloride cation	hcl+
256	HBr	hydrogen bromide	hbr
257	HBr^-	hydrogen bromide anion	hbr-
258	HBr⁺	hydrogen bromide cation	hbr+
259	HI	Hydrogen iodide	hi
260	HI⁺	Hydrogen iodide cation	hi+
261	H₂F⁺	dihydrogen fluoride cation	h2f+
262	H₂Cl⁺	dihydrogen monochloride cation	h2cl+
263	H₂Br⁺	protonated hydrogen bromide	h2br+
264	H₂I⁺	Iodonium	h2i+
265	Ne	Neon atom	ne
266	Ne^-	Neon atom anion	ne-
267	Ne⁺	Neon atom cation	ne+
268	Ar	Argon atom	ar
269	Ar^-	Argon atom anion	ar-
270	Ar⁺	Argon atom cation	ar+
271	Fe	Iron atom	fe
272	Kr	Krypton atom	kr
273	Kr⁺	Krypton cation	kr+
274	Xe	Xenon atom	xe
275	HeLi⁺	Helium Lithium cation	heli+
276	NeH	neon hydrogen	neh
277	NeH⁺	neon hydrogen cation	neh+
278	ArH⁺	Argon hydride cation	arh+
279	KrH⁺	Protonated Krypton	krh+
280	XeH⁺	Xenon, protonated	xeh+
281	H₂Ar	H2 Ar dimer	h2ar
282	Co	Cobalt atom	cobalt
283	Ni	Nickel atom	ni
284	Li₂	Lithium diatomic	li2
285	Li₂^-	lithium diatomic anion	li2-
286	Li₂⁺	lithium diatomic cation	li2+
287	NaLi	lithium sodium	lina
288	NaLi^-	lithium sodium anion	lina-
289	NaLi⁺	lithium sodium cation	lina+
290	LiK	Lithium Potassium	lik
291	Na₂	Sodium diatomic	na2
292	Na₂^-	sodium diatomic anion	na2-
293	Na₂⁺	sodium diatomic cation	na2+
294	NaK	Sodium Potassium	nak
295	NaK⁺	Sodium Potassium diatomic cation	nak+
296	K₂	Potassium diatomic	k2
297	Cu₂	Copper diatomic	cu2
298	LiBe	Lithium Beryllium	libe
299	LiMg	Lithium magnesium	limg
300	NaBe	Sodium Beryllium	nabe
301	NaMg	Sodium Magnesium	namg
302	Be₂	Beryllium diatomic	be2
303	Be₂^-	Beryllium diatomic anion	be2-
304	Be₂⁺	Beryllium diatomic cation	be2+
305	BeMg	Beryllium Magnesium	bemg
306	Mg₂	Magnesium diatomic	mg2
307	Mg₂^-	magnesium diatomic anion	mg2-
308	Mg₂⁺	magnesium diatomic cation	mg2+
309	Ca₂	Calcium diatomic	ca2
310	LiB	Lithium boride	lib
311	LiAl	Lithium Aluminum	lial
312	NaAl	Sodium aluminum	naal
313	BeB	Beryllium monoboride	beb
314	B₂	Boron diatomic	b2
315	B₂^-	Boron diatomic anion	b2-
316	B₂⁺	Boron diatomic cation	b2+
317	Al₂	Aluminum diatomic	al2
318	Al₂^-	aluminum diatomic anion	al2-
319	Al₂⁺	aluminum diatomic cation	al2+
320	BGa	Boron Gallium	bga
321	AlGa	Aluminum Gallium	alga
322	Ga₂	Gallium diatomic	ga2
323	HBBH	Diborane(2)	hbbh
324	LiBH₄	Lithium borohydride	libh4
325	B₂H₄	Diborane(4) D2d	b2h4
326	HBHHBH	Diborane(4) C2V	hbhhbh
327	B₂H₆	Diborane	b2h6
328	B₂H₆⁺	Diborane cation	b2h6
329	Al₂H₆	dialane	al2h6
330	Ga₂H₆	digallane	ga2h6
331	LiC	Lithium Carbide	lic
332	BeC	Beryllium Carbide	bec
333	CaC	Calcium monocarbide	cac
334	BC	boron monocarbide	bc
335	BC^-	boron monocarbide anion	bc-
336	BC⁺	boron monocarbide cation	bc+
337	BSi	Boron silicide	bsi
338	C₂	Carbon diatomic	c2
339	C₂^-	carbon diatomic anion	c2-
340	C₂⁺	carbon diatomic cation	c2+
341	SiC	silicon monocarbide	sic
342	SiC^-	silicon monocarbide anion	sic-
343	SiC⁺	silicon monocarbide cation	sic+
344	Si₂	Silicon diatomic	si2
345	Si₂^-	silcon diatomic anion	si2-
346	Si₂⁺	silcon diatomic cation	si2+
347	GeC	Germanium monocarbide	gec
348	SiGe	Silicon Germanium	sige
349	Ge₂	Germanium diatomic	ge2
350	C₂H	Ethynyl radical	c2h
351	C₂H^-	Ethynyl anion	c2h-
352	C₂H⁺	Ethynyl cation	c2h+
353	ZnCH₂	Zinc methylene	znch2
354	C₂H₂	Acetylene	c2h2
355	C₂H₂⁺	acetylene cation	c2h2+
356	CCH₂	vinylidene	vinylidene
357	H₂CC^-	vinylidene anion	h2cc-
358	HCCH^-	acetylene anion	c2h2-
359	Si₂H₂	disilyne	si2h2
360	CH₃Li	methyl lithium	ch3li
361	CuCH₃	monomethyl copper	cuch3
362	ZnCH₃	Zinc monomethyl	znch3
363	CH₂BH	methyleneborane	ch2bh
364	C₂H₃	vinyl	c2h3
365	C₂H₃^-	vinyl anion	c2h3-
366	C₂H₃⁺	vinyl cation	c2h3+
367	C₂H₄	Ethylene	c2h4
368	C₂H₄^-	Ethylene anion	c2h4-
369	C₂H₄⁺	Ethylene cation	c2h4+
370	CH₃CH	methylmethylene	ch3ch
371	CH₂SiH₂	silaethylene	ch2sih2
372	Si₂H₄	Disilene	si2h4
373	CH₃BH₂	methylborane	ch3bh2
374	C₂H₅	Ethyl radical	c2h5
375	C₂H₅^-	Ethyl anion	c2h5-
376	C₂H₅⁺	Ethyl cation	c2h5+
377	C₂H₆	Ethane	c2h6
378	C₂H₆⁺	ethane cation	c2h6+
379	CH₃SiH₃	methyl silane	ch3sih3
380	GeH₃CH₃	methyl germane	geh3ch3
381	C₂H₇⁺	Ethane, protonated	c2h7+
382	LiN	Lithium Nitride	lin
383	LiN⁺	Lithium Nitride cation	lin+
384	LiP	Lithium monophosphide	lip
385	BeN	Beryllium mononitride	ben
386	BeN^-	Beryllium mononitride anion	ben-
387	BeN⁺	Beryllium mononitride cation	ben+
388	MgN	Magnesium Nitride	mgn
389	BN^-	boron nitride anion	bn-
390	AlN^-	aluminum mononitride anion	aln-
391	AlN⁺	aluminum mononitride cation	aln+
392	BP	Boron monophosphide	bp
393	AlP	Aluminum monophosphide	alp
394	GaN	Gallium mononitride	gan
395	GaP	Gallium monophosphide	gap
396	GaAs	Gallium arsenide	gaas
397	BN	boron nitride	bn
398	BN⁺	boron nitride cation	bn+
399	AlN	Aluminum nitride	aln
400	CN	Cyano radical	cn
401	CN^-	cyanide anion	cn-
402	CN⁺	Cyano cation	cn+
403	CP	Carbon monophosphide	cp
404	CP^-	carbon monophosphide anion	cp-
405	CP⁺	carbon monophosphide cation	cp+
406	SiN	Silicon nitride	sin
407	SiN^-	silicon mononitride anion	sin-
408	SiN⁺	silicon mononitride cation	sin+
409	SiP	Silicon monophosphide	sip
410	SiP^-	Silicon monophosphide anion	sip-
411	SiP⁺	Silicon monophosphide cation	sip+
412	TiN	Titanium mononitride	tin
413	N₂	Nitrogen diatomic	n2
414	N₂^-	nitrogen diatomic anion	n2-
415	N₂⁺	diatomic nitrogen cation	n2+
416	PN	Phosphorus mononitride	pn
417	PN^-	phosphorus nitride anion	pn-
418	PN⁺	phosphorus nitride cation	pn+
419	P₂	Phosphorus diatomic	p2
420	P₂^-	phosphorus diatomic anion	p2-
421	P₂⁺	phosphorus diatomic cation	p2+
422	AsN	Arsenic mononitride	asn
423	AsP	Arsenic monophosphide	asp
424	SbN	Antimony nitride	sbn
425	As₂	Arsenic diatomic	as2
426	HNB	hydrogen nitrogen boron	hnb
427	HNC	hydrogen isocyanide	hnc
428	HCN	Hydrogen cyanide	hcn
429	HCN^-	Hydrogen cyanide anion	hcn-
430	HCN⁺	hydrogen cyanide cation	hcn+
431	HNC⁺	hydrogen isocyanide cation	hnc+
432	HCP	Phosphaethyne	hcp
433	HCP⁺	Phosphaethyne cation	hcp+
434	NNH	Dinitrogen monohydride	nnh
435	NNH⁺	Dinitrogen monohydride cation	nnh+
436	HPO	Hydrogen phosphorus oxide	hpo
437	HPO⁺	Hydrogen phosphorus oxide cation	hpo+
438	LiNH₂	lithium amide	linh2
439	HBNH	Boranimine	hbnh
440	CNH₂	Aminomethylidyne radical	cnh2
441	CNH₂⁺	N-protonated hydrogen isocyanide	cnh2+
442	H₂CN	Dihydrogen cyanide radical	h2cn
443	H₂CN⁺	hydrocyanonium cation	h2cn+
444	HCNH	methyleneazane	hcnh
445	HCNH⁺	N-protonated HCN	hcnh+
446	H₂NN	Isodiazene	h2nn
447	N₂H₂	(E)-diazene	n2h2
448	N₂H₂	(Z)-Diazene	n2h2z
449	N₂H₂⁺	trans-diazene cation	n2h2+
450	CH₂NH	Methanimine	ch3n
451	CH₂NH⁺	Methanimine cation	ch2nh+
452	CHNH₂	aminomethylene	chnh2
453	CHNH₂⁺	Aminocarbene cation	chnh2+
454	CH₂PH	Phosphaethene	ch3p
455	BH₂NH₂	Boranamine	bh2nh2
456	CH₂NH₂⁺	methyleneamine cation	ch2nh2+
457	N₂H₄	Hydrazine	n2h4
458	N₂H₄⁺	hydrazine cation	n2h4+
459	P₂H₄	Diphosphine	p2h4
460	CH₃NH₂	methyl amine	ch3nh2
461	CH₃NH₂⁺	methyl amine cation	ch3nh2+
462	CH₃PH₂	Methyl phosphine	ch3ph2
463	SiH₃NH₂	Silane, amino	sih3nh2
464	N₂H₅⁺	protonated hydrazine	n2h5+
465	BH₃PH₃	borane phosphine	bh3ph3
466	BH₃NH₃	borane ammonia	bh3nh3
467	CH₃NH₃	methyl ammonium radical	ch3nh3
468	CH₃NH₃⁺	protonated methylamine	ch3nh3+
469	CH₃PH₃⁺	methyl phosphine, protonated	ch3ph3+
470	NH₃NH₃	Ammonia Dimer	nh3nh3
471	N₂H₇⁺	ammonia ammonium dimer	n2h7+
472	LiO	lithium oxide	lio
473	LiO^-	lithium oxide anion	lio-
474	LiO⁺	lithium oxide cation	lio+
475	LiS	Lithium monosulfide	lis
476	LiS⁺	Lithium sulfide cation	lis+
477	NaO	sodium monoxide	nao
478	NaO^-	sodium oxide anion	nao-
479	NaO⁺	sodium oxide cation	nao+
480	KO	Potassium monoxide	ko
481	KO⁺	Potassium monoxide cation	ko+
482	CuO	Copper Monoxide	cuo
483	LiSe	Lithium monoselenide	lise
484	BeO	beryllium oxide	beo
485	BeO^-	Beryllium monoxide anion	beo-
486	BeO⁺	Beryllium monoxide cation	beo+
487	BeS	beryllium sulfide	bes
488	MgO	magnesium oxide	mgo
489	MgO^-	magnesium oxide anion	mgo-
490	MgO⁺	magnesium oxide cation	mgo+
491	CaO	Calcium monoxide	cao
492	MgS	magnesium sulfide	mgs
493	MgS^-	magnesium sulfide anion	mgs-
494	MgS⁺	magnesium sulfide cation	mgs+
495	CaS	Calcium sulfide	cas
496	ZnO	zinc monoxide	zno
497	ZnS	Zinc sulfide	zns
498	BeS^-	Beryllium monosulfide anion	bes-
499	BeS⁺	Beryllium monosulfide cation	bes+
500	BO	boron monoxide	bo
501	BO^-	boron monoxide anion	bo-
502	AlO	Aluminum monoxide	alo
503	AlO^-	Aluminum monoxide anion	alo-
504	AlO⁺	aluminum monoxide cation	alo+
505	BS	boron sulfide	bs
506	BS^-	boron monosulfide anion	bs-
507	BS⁺	boron monosulfide cation	bs+
508	AlS	Aluminum sulfide	als
509	AlS^-	aluminum monosulfide anion	als-
510	AlS⁺	aluminum monosulfide cation	als+
511	ScO	Scandium monoxide	sco
512	GaO	Gallium monoxide	gao
513	GaS	Gallium monosulfide	gas
514	BO⁺	boron monoxide cation	bo+
515	CO	Carbon monoxide	co
516	CO^-	carbon monoxide anion	co-
517	CO⁺	carbon monoxide cation	co+
518	CS	carbon monosulfide	cs
519	CS^-	carbon monosulfide anion	cs-
520	CS⁺	carbon monosulfide cation	cs+
521	SiO^-	silicon monoxide anion	sio-
522	SiO⁺	silicon monoxide cation	sio+
523	SiS^-	silicon monosulfide anion	sis-
524	SiS⁺	silicon monosulfide cation	sis+
525	TiO	Titanium monoxide	tio
526	CSe	Carbon monoselenide	cse
527	CSe^-	Carbon monoselenide anion	cse-
528	CSe⁺	Carbon monoselenide cation	cse+
529	GeO⁺	Germanium monoxide cation	geo+
530	GeS	Germanium monosulfide	ges
531	SiSe	Silicon Monoselenide	sise
532	SiSe⁺	Silicon Monoselenide cation	sise+
533	GeSe	Germanium monoselenide	gese
534	NO	Nitric oxide	no
535	NO^-	nitric oxide anion	no-
536	NO⁺	nitric oxide cation	no+
537	NS^-	nitrogen sulfide anion	ns-
538	NS⁺	nitrogen sulfide cation	ns+
539	PO^-	phosphorus monoxide anion	po-
540	PO⁺	phosphorus monoxide cation	po+
541	PS	phosphorus sulfide	ps
542	PS^-	phosphorus monosulfide anion	ps-
543	PS⁺	phosphorus monosulfide cation	ps+
544	VO	Vanadium monoxide	vo
545	AsO	Arsenic monoxide	aso
546	NSe	Nitrogen monoselenide	nse
547	AsS	Arsenic monosulfide	ass
548	PSe	Phosphorus monoselenide	pse
549	AsSe	Arsenic monoselenide	asse
550	O₂	Oxygen diatomic	o2
551	O₂^-	oxygen diatomic anion	o2-
552	O₂^--	dioxygen dianion	o2--
553	O₂⁺	diatomic oxygen cation	o2+
554	SO^-	sulfur monoxide anion	so-
555	SO⁺	sulfur monoxide cation	so+
556	S₂	Sulfur diatomic	s2
557	S₂^-	sulfur diatomic anion	s2-
558	S₂⁺	sulfur diatomic cation	s2+
559	SeO	Selenium monoxide	seo
560	SeO^-	selenium monoxide anion	seo-
561	SeO⁺	selenium monoxide cation	seo+
562	SeS	Selenium monosulfide	ses
563	SeS^-	selenium monosulfide anion	ses-
564	SeS⁺	selenium monosulfide cation	ses+
565	TeO	Tellurium monoxide	teo
566	Se₂	Selenium diatomic	se2
567	Se₂^-	selenium diatomic anion	se2-
568	Se₂⁺	selenium diatomic cation	se2+
569	Te₂	Tellurium diatomic	te2
570	LiOH	lithium hydroxide	lioh
571	NaOH	sodium hydroxide	naoh
572	KOH	Potassium hydroxide	koh
573	BeOH	beryllium monohydroxide	beoh
574	MgOH	magnesium hydroxide	mgoh
575	CaOH	Calcium monohydroxide	caoh
576	HBO	Boron hydride oxide	hbo
577	COH	Hydroxymethylidyne	coh
578	COH⁺	Carbon Monoxide, protonated	coh+
579	HCO	Formyl radical	hco
580	HCO^-	formyl anion	hco-
581	HCO⁺	Formyl cation	hco+
582	HCS	Thioformyl radical	hcs
583	HCS^-	Thioformyl anion	hcs-
584	HCS⁺	Thioformyl cation	hcs+
585	HNO	Nitrosyl hydride	hno
586	HNO^-	Nitrosyl hydride anion	hno-
587	HNO⁺	Nitrosyl hydride cation	hno+
588	NOH	Hydroxyimidogen	noh
589	NOH⁺	O-protonated nitric oxide	noh+
590	HNS	Sulfur imide	hns
591	HNS^-	Sulfur imide anion	hns-
592	HO₂	Hydroperoxy radical	ho2
593	HO₂^-	Hydroperoxy anion	ho2-
594	HO₂⁺	Hydroperoxy cation	ho2+
595	HSO⁺	Sulfur Monoxide, S-protonated	HSO+
596	SOH	Sulfur Hydroxide	soh
597	SOH⁺	Sulfur Monoxide, protonated	soh+
598	HS₂	Thiosulfeno radical	hs2
599	H₂CO	Formaldehyde	h2co
600	H₂CO^-	formaldehyde anion	h2co-
601	H₂CO⁺	formaldehyde cation	h2co+
602	HOCH	hydroxycarbene	hoch
603	H₂CS^-	thioformaldehyde anion	h2cs-
604	H₂CS⁺	thioformaldehyde cation	h2cs+
605	H₂CSe	Selenoformaldehyde	h2cse
606	H₂NO	nitroxide	h2no
607	H₂O₂	Hydrogen peroxide	h2o2
608	H₂O₂⁺	Hydrogen peroxide cation	h2o2+
609	H₂OO	water oxide	h2oo
610	HOSH	hydrogen thioperoxide	hosh
611	H₂Se₂	hydrogen diselenide	h2se2
612	CH₂OH	Hydroxymethyl radical	ch2oh
613	CH₂OH⁺	hydroxymethyl cation	ch2oh+
614	CH₃O	Methoxy radical	ch3o
615	CH₃O^-	methoxy anion	ch3o-
616	CH₃O⁺	Methoxy cation	ch3o+
617	CH₃S	thiomethoxy	ch3s
618	H₂CSH⁺	Thioformaldehyde, protonated	h2csh+
619	NH₂OH	hydroxylamine	nh2oh
620	NH₂OH⁺	Hydroxylamine cation	nh2oh+
621	NH₃O	Ammonia Oxide	nh3o
622	H₂POH	Phosphinous acid	h2poh
623	H₃PO	Phosphine oxide	h3po
624	NH₂SH	Thiohydroxylamine	nh2sh
625	NH₃S	sulfidoazane	nh3s
626	H₃O₂⁺	hydrogen peroxide, protonated	h3o2+
627	CH₃OH	Methyl alcohol	ch3oh
628	CH₃OH^-	Methyl alcohol anion	ch3oh-
629	CH₃OH⁺	Methyl alcohol cation	ch3oh+
630	CH₃SH⁺	Methanethiol cation	ch3sh+
631	SiH₃OH	silanol	sih3oh
632	CH₃SeH	Methane selenol	ch3seh
633	NH₂OH₂⁺	protonated hydroxylamine	nh2oh2+
634	NH₃OH⁺	N-protonated hydroxylamine	nh3oh+
635	H₂OH₂O	water dimer	h2oh2o
636	CH₃OH₂⁺	Methanol, protonated	ch3oh2+
637	H₂ONH₃	Water Ammonia Dimer	h2onh3
638	H₅O₂⁺	Dihydroxonium ion	h5o2+
639	LiF	lithium fluoride	lif
640	LiCl^-	lithium chloride anion	licl-
641	LiCl⁺	lithium chloride cation	licl+
642	NaF	sodium fluoride	naf
643	NaF^-	sodium fluoride anion	naf-
644	NaF⁺	sodium fluoride cation	naf+
645	KF	Potassium Fluoride	kf
646	NaCl	Sodium Chloride	nacl
647	NaCl^-	sodium chloride anion	nacl-
648	NaCl⁺	sodium chloride cation	nacl+
649	KCl	Potassium Chloride	kcl
650	CuF	Copper monofluoride	cuf
651	LiBr	Lithium Bromide	libr
652	LiBr^-	lithium bromide anion	libr-
653	LiBr⁺	lithium bromide cation	libr+
654	CuCl	Copper monochloride	cucl
655	NaBr	Sodium Bromide	nabr
656	NaBr^-	sodium bromide anion	nabr-
657	NaBr⁺	sodium bromide cation	nabr+
658	KBr	Potassium Bromide	kbr
659	LiI	Lithium Iodide	lii
660	NaI	Sodium Iodide	nai
661	KI	Potassium Iodide	ki
662	LiF^-	lithium fluoride anion	lif-
663	LiF⁺	lithium fluoride cation	lif+
664	BeF	Beryllium monofluoride	bef
665	BeF^-	Beryllium monofluoride anion	bef-
666	BeF⁺	Beryllium monofluoride cation	bef+
667	BeCl	beryllium monochloride	becl
668	MgF	Magnesium monofluoride	mgf
669	MgF^-	magnesium fluoride anion	mgf-
670	MgF⁺	magnesium fluoride cation	mgf+
671	CaF	Calcium monofluoride	caf
672	MgCl	magnesium monochloride	mgcl
673	MgCl^-	magnesium monochloride anion	mgcl-
674	MgCl⁺	magnesium monochloride cation	mgcl+
675	CaCl	calcium monochloride	cacl
676	TiCl	Titanium Monochloride	ticl
677	ZnF	Zinc monofluoride	znf
678	ZnF^-	Zinc monofluoride anion	znf-
679	ZnF⁺	Zinc monofluoride cation	znf+
680	ZnCl	Zinc monochloride	zncl
681	CaBr	Calcium monobromide	cabr
682	BeCl^-	beryllium monochloride anion	becl-
683	BeCl⁺	beryllium monochloride cation	becl+
684	BF	Boron monofluoride	bf
685	BF^-	Boron monofluoride anion	bf-
686	BF⁺	Boron monofluoride cation	bf+
687	AlF^-	Aluminum monofluoride anion	alf-
688	AlF⁺	Aluminum monofluoride cation	alf+
689	BCl	boron monochloride	bcl
690	BCl^-	boron monochloride anion	bcl-
691	BCl⁺	boron monochloride cation	bcl+
692	AlCl	Aluminum monochloride	alcl
693	AlCl^-	aluminum monochloride anion	alcl-
694	AlCl⁺	aluminum monochloride cation	alcl+
695	ScF	Scandium monofluoride	scf
696	BBr	Boron monobromide	bbr
697	GaF	Gallium monofluoride	gaf
698	GaF⁺	Gallium monofluoride cation	gaf+
699	AlBr	Aluminum monobromide	albr
700	GaCl	Gallium monochloride	gacl
701	GaCl⁺	Gallium monochloride cation	gacl+
702	AlI	Aluminum monoiodide	ali
703	GaBr	Gallium monobromide	gabr
704	CF	Fluoromethylidyne	cf
705	CF^-	carbon monofluoride anion	cf-
706	CF⁺	carbon monofluoride cation	cf+
707	CCl	carbon monochloride	ccl
708	CCl^-	carbon monochloride anion	ccl-
709	CCl⁺	carbon monochloride cation	ccl+
710	SiF	silicon monofluoride	sif
711	SiF^-	silicon monofluoride anion	sif-
712	SiF⁺	silicon monofluoride cation	sif+
713	SiCl	Clorosilylidyne	sicl
714	SiCl^-	silicon monochloride anion	sicl-
715	SiCl⁺	silicon monochloride cation	sicl+
716	CBr	Carbon monobromide	cbr
717	GeF	Germanium monofluoride	gef
718	GeF⁺	Germanium monofluoride cation	gef+
719	GeCl	Germanium monochloride	gecl
720	SiBr	Silicon monobromide	sibr
721	SiBr⁺	Silicon monobromide cation	sibr+
722	NF	nitrogen fluoride	nf
723	NF^-	nitrogen monofluorine anion	nf-
724	NF⁺	nitrogen monofluoirde cation	nf+
725	NCl^-	nitrogen monochloride anion	ncl-
726	NCl⁺	nitrogen monochloride cation	ncl+
727	PF	phosphorus monofluoride	pf
728	PF^-	phosphorus monofluoride anion	pf-
729	PF⁺	phosphorus monofluoride cation	pf+
730	PCl	phosphorus chloride	pcl
731	PCl^-	phosphorus monochloride anion	pcl-
732	PCl⁺	phosphorus monochloride cation	pcl+
733	AsF	Arsenic monofluoride	asf
734	NBr	nitrogen monobromide	nbr
735	AsCl	Arsenic monochloride	ascl
736	PBr	Phosphorus monobromide	pbr
737	SbF	Antimony monofluoride	sbf
738	SbCl	Antimony monochloride	sbcl
739	FO	Oxygen monofluoride	fo
740	FO^-	flourine oxide anion	fo-
741	FO⁺	fluorine monoxide cation	fo+
742	ClO	Monochlorine monoxide	clo
743	ClO^-	chlorine monoxide anion	clo-
744	ClO⁺	chlorine monoxide cation	clo+
745	SF	Monosulfur monofluoride	sf
746	SF^-	sulfur monofluoride anion	sf-
747	SF⁺	sulfur monofluoride cation	sf+
748	SCl^-	sulfur monochloride anion	scl-
749	BrO	Bromine monoxide	bro
750	BrO^-	Bromine monoxide anion	bro-
751	BrO⁺	Bromine monoxide cation	bro+
752	SeF	Selenium monofluoride	sef
753	SBr	Sulfur monobromide radical	sbr
754	SBr⁺	Sulfur monobromide cation	sbr+
755	SeCl	Selenium monochloride	secl
756	IO	Iodine monoxide	io
757	SeBr	Selenium monobromide	sebr
758	BrCl	Bromine monochloride	brcl
759	F₂	Fluorine diatomic	f2
760	F₂^-	flourine diatomic anion	f2-
761	F₂⁺	flourine diatomic cation	f2+
762	ClF	Chlorine monofluoride	clf
763	ClF^-	clorine monofluoride anion	clf-
764	ClF⁺	clorine monofluoride cation	clf+
765	Cl₂	Chlorine diatomic	cl2
766	Cl₂^-	chlorine diatomic anion	cl2-
767	BrF	Bromine monofluoride	brf
768	BrF^-	bromine fluoride anion	brf-
769	BrF⁺	bromine fluoride cation	brf+
770	BrCl^-	bromine chloride anion	brcl-
771	BrCl⁺	bromine chloride cation	brcl+
772	IF	Iodine monofluoride	if
773	Br₂	Bromine diatomic	br2
774	Br₂^-	bromine diatomic anion	br2-
775	Br₂⁺	bromine diatomic cation	br2+
776	ICl	Iodine monochloride	icl
777	IBr	Iodine monobromide	ibr
778	I₂	Iodine diatomic	i2
779	I₂⁺	Iodine diatomic cation	i2+
780	HCF	Fluoromethylene	hcf
781	HCCl	Chloromethylene	hccl
782	HSiF	fluorosilylene	hsif
783	HSiCl	Chlorosilylene	hsicl
784	HSiBr	monobromosilylene	hsibr
785	CHBr	bromomethylene	chbr
786	HOF	Hypofluorous acid	hfo
787	DOCl	Hypochlorous acid-d	docl
788	HOCl	hypochlorous acid	hocl
789	HOCl⁺	hypochlorous acid cation	hocl+
790	HOBr	Hypobromous acid	hobr
791	HOBr⁺	Hypobromous acid cation	hobr+
792	HOI	Hypoiodous acid	hoi
793	F₂H⁺	Fluorine, protonated	f2h+
794	FHF	Hydrogen difluoride	fhf
795	FHF^-	Hydrogen difluoride anion	fhf-
796	ClFH⁺	Chlorine fluoride, F-protonated	clfh+
797	FClH⁺	Chlorine fluoride, Cl-protonated	fclh+
798	Cl₂H⁺	Chlorine, protonated	cl2h+
799	CH₂Br	bromomethyl radical	ch2br
800	CH₂F	fluoromethyl radical	ch2f
801	CH₂F⁺	fluoromethyl cation	ch2f+
802	CH₂Cl⁺	chloromethyl cation	ch2cl+
803	CH₂Cl	chloromethyl radical	ch2cl
804	NH₂F	monofluoroamine	nh2f
805	NH₂Cl	chloramine	nh2cl
806	H₂F₂	Hydrogen fluoride dimer	h2f2
807	CH₃F⁺	methyl fluoride cation	ch3f+
808	CD₃F	methylfluoride-d3	cd3f
809	CH₃F	Methyl fluoride	ch3f
810	CD₃Cl	methyl chloride d3	cd3cl
811	CH₃Cl⁺	Methyl chloride cation	ch3cl+
812	CH₃Br	methyl bromide	ch3br
813	GeH₃F	monofluorogermane	geh3f
814	GeH₃Cl	monochlorogermane	geh3cl
815	SiH₃Br	bromosilane	sih3br
816	CH₃I	methyl iodide	ch3i
817	SiH₃I	Silyl Iodide	sih3i
818	NH₃Cl⁺	protonated monochloroammonia	nh3cl+
819	CH₃ClH⁺	methyl chloride, protonated	ch3clh+
820	NH₄Cl	Ammonium chloride	nh4cl
821	LiNe⁺	Lithium Neon cation	line+
822	Ne₂	Neon diatomic	ne2
823	Ne₂⁺	Neon diatomic cation	ne2+
824	Ar₂	Argon diatomic	ar2
825	Ar₂⁺	Argon diatomic cation	ar2+
826	Li₃	Lithium trimer	li3
827	Li₃⁺	Lithium trimer cation	li3+
828	C₃	carbon trimer	c3
829	C₃⁺	carbon trimer cation	c3+
830	SiC₂	Silicon dicarbide	sic2
831	C₃H₃	cyclopropenyl radical	cpr
832	C₃H₃	Propargyl radical	propargyl
833	C₃H₃^-	Propargyl anion	c3h3-
834	C₃H₃⁺	cyclopropenyl cation	cpr+
835	C₃H₃⁺	Propargyl cation	c3h3+
836	C₃H₄	cyclopropene	cprop
837	CH₂CCH₂	allene	allene
838	CH₃CCH	propyne	propyne
839	C₃H₅	Allyl radical	allyl
840	C₃H₅⁺	Allyl cation	allyl+
841	CH₃CHCH	1-propenyl radical	ch3chch
842	Zn(CH₃)₂	dimethyl zinc	dmz
843	C₃H₆	Cyclopropane	c3h6
844	CH₂CHCH₃	Propene	propene
845	C₃H₇	n-Propyl radical	npropyl
846	C₃H₇⁺	cyclopropane, protonated	c3h7+
847	CH₃CHCH₃	Isopropyl radical	isopropyl
848	CH₃CHCH₃⁺	Isopropyl cation	prop2yl+
849	C₃H₈	Propane	propane
850	SiH₂(CH₃)₂	dimethylsilane	dms
851	LiCN	lithium cyanide	licn
852	NaCN	Sodium Cyanide	nacn
853	KCN	Potassium cyanide	kcn
854	CuCN	Copper cyanide	cucn
855	ZnCN	Zinc monocyanide	zncn
856	ZnNC	Zinc isocyanide	znnc
857	AlCN	Aluminum monocyanide	alcn
858	AlNC	Aluminum isocyanide	alnc
859	CN₂	3H-Diazirin-3-ylidene	cn2
860	CNN	Diazocarbene	cnn
861	NCN	Cyanoimidogen	ncn
862	N₃	azide radical	n3
863	N₃^-	azide anion	n3-
864	N₃⁺	azide cation	n3+
865	HCCN	cyanomethylene	hccn
866	HCNN	diazomethyl radical	hcnn
867	HN₃	hydrogen azide	hn3
868	HN₃⁺	Hydrazoic acid cation	hn3+
869	HNCNH	diiminomethane	hncnh
870	CH₂N₂	diazirine	ch2n2
871	CH₂NN	diazomethane	ch2nn
872	NH₂CN	cyanamide	cyanamide
873	HNNNH⁺	1,2-Triazadienium	n2h3+
874	NH₂NN⁺	hydrazoic acid, protonated	nh2nn+
875	CH₃CN	Acetonitrile	ch3cn
876	CH₃CN^-	acetonitrile anion	ch3cn-
877	CH₃CN⁺	Acetonitrile cation	ch3cn+
878	CH₃NC	methyl isocyanide	ch3nc
879	CHNCH₂	2H-Azirine	c157164
880	CHNHCH	1H-Azirine	chnhch
881	H₂CCNH	Ethenimine	ch2cnh
882	H₂CNCH	methyleneaminomethylene	ch2nch
883	HCCNH₂	Ethynamine	hccnh2
884	HCNCH₂⁺	2H-Azirine cation	hcnch2+
885	HNCNH₂⁺	diiminomethane, protonated	hncnh2+
886	NCNH₃⁺	Cyanamide, protonated	ncnh3+
887	NH₂CNH⁺	cyanamide, cn protonated	nh2cnh+
888	NH₃CN⁺	cyanamide, amine protonated	nh3cn+
889	CH₂CHNH	vinylazine	ch2chnh
890	CH₃CHN	methylmethaniminyl radical	ch3chn
891	NHCHNH₂	aminomethanimine	cn2h4
892	C₂H₅N	Aziridine	c2h5n
893	CH₂CHNH₂	aminoethene	aminoethene
894	CH₂NCH₃	N-methylmethanimine	nmm
895	CH₃CHNH	ethanimine	ethanimine
896	NH₂BHNH₂	diaminoborane	nh2bhnh2
897	C₂H₅NH⁺	Protonated Aziridine	c2h5nh+
898	C₂H₆N⁺	aziridine, protonated	c2h6n+
899	NH₂CH₂NH₂	diaminomethane	nh2ch2nh2
900	CH₃CH₂NH₂	Ethylamine	etam
901	CH₃NHCH₃	Dimethylamine	ch3nhch3
902	CH₃PHCH₃	dimethylphosphine	ch3phch3
903	NH₂CH₂NH₃⁺	diaminoethane, protonated	pdam
904	(CH₃)₂NH₂⁺	dimethylammonium cation	dmam
905	CH₃CH₂NH₃⁺	ethylamine, protonated	pea
906	Li₂O	dilithium oxide	li2o
907	Li₂O⁺	dilithium oxide cation	li2o+
908	Li₂S	dilithium sulfide	li2s
909	Na₂O	disodium monoxide	na2o
910	LiO₂	Lithium dioxide	lio2
911	NaO₂	Sodium superoxide	nao2
912	CCO	Dicarbon monoxide	cco
913	CNO^-	fulminate	cno-
914	NCO	isocyanato radical	nco
915	NCO^-	cyanate	nco-
916	SCN	thiocyanato radical	scn
917	SCN^-	thiocyanide anion	scn-
918	BO₂	Boron dioxide	bo2
919	BO₂^-	Boron dioxide anion	bo2-
920	BO₂⁺	Boron dioxide cation	bo2+
921	N₂O	Nitrous oxide	n2o
922	N₂O^-	Nitrous oxide anion	n2o-
923	N₂O⁺	Nitrous oxide cation	n2o+
924	NNS	Nitrogen sulfide	nns
925	PPO	Phosphorus oxide phosphide	ppo
926	CO₂	Carbon dioxide	co2
927	CO₂^-	Carbon dioxide anion	co2-
928	CO₂⁺	Carbon dioxide cation	co2+
929	OCS⁺	Carbonyl sulfide cation	cos+
930	SiO₂	silicon dioxide	sio2
931	CS₂	Carbon disulfide	cs2
932	CS₂^-	Carbon disulfide anion	cs2-
933	CS₂⁺	Carbon disulfide cation	cs2+
934	TiO₂	Titanium dioxide	tio2
935	SiS₂	Silicon disulfide	sis2
936	GeO₂	Germanium dioxide	geo2
937	OCSe	Carbonyl selenide	ocse
938	SCSe	Carbon sulfide selenide	scse
939	GeS₂	Germanium disulfide	ges2
940	CSe₂	Carbon diselenide	cse2
941	SCTe	Carbon sulfide Telluride	scte
942	NO₂	Nitrogen dioxide	no2
943	NO₂^-	Nitrogen dioxide anion	no2-
944	NO₂⁺	Nitrogen dioxide cation	no2+
945	NSO	sulfinyl amidogen	NSO
946	PO₂	Phosphorus dioxide	po2
947	PO₂^-	Phosphorus dioxide anion	po2-
948	PO₂⁺	Phosphorus dioxide cation	po2+
949	SNO	Nitrogen oxide sulfide	sno
950	AsO₂	Aresenic dioxide	aso2
951	O₃	Ozone	o3
952	O₃^-	Ozone anion	o3-
953	O₃⁺	Ozone cation	o3+
954	SO₂^-	Sulfur dioxide anion	so2-
955	SO₂⁺	Sulfur dioxide cation	so2+
956	SSO	Disulfur monoxide	sso
957	S₃	Sulfur trimer	s3
958	S₃^-	Sulfur trimer anion	s3-
959	S₃⁺	Sulfur trimer cation	s3+
960	SeO₂	Selenium dioxide	seo2
961	SeO₂⁺	Selenium dioxide cation	seo2+
962	TeO₂	Tellurium Dioxide	teo2
963	HCCO	ketenyl radical	ketenyl
964	CS₂H⁺	Carbon disulfide, protonated	cs2h+
965	HCNO	fulminic acid	hcno
966	HNCO	Isocyanic acid	hnco
967	HOCN	cyanic acid	hocn
968	HNCS	Isothiocyanic acid	hncs
969	HSCN	thiocyanic acid	hscn
970	HCO₂^-	formate anion	hco2-
971	HNNO	nitrosoazane	hnno
972	HNNO⁺	Nitrous oxide, N-protonated	hnno+
973	NNOH⁺	Nitrous Oxide, O-protonated	nnoh+
974	HCOO	formate neutral radical	hcoo
975	HOCO	Hydrocarboxyl radical	hoco
976	HOCO⁺	Hydrocarboxyl cation	hoco+
977	HNO₂	Nitrous acid	hno2
978	HNO₂⁺	nitrous acid cation	hno2+
979	O₃H⁺	protonated ozone	o3h+
980	SO₂H⁺	protonated sulfur dioxide	so2h+
981	C₂H₂O	Oxirene	oxirene
982	CH₂CO	Ketene	ch2co
983	CH₂CO⁺	Ketene cation	ch2co+
984	HCCOH	ethynol	hccoh
985	Be(OH)₂	Beryllium hydroxide	beo2h2
986	Mg(OH)₂	Magnesium dihydroxide	h2mgo2
987	NH₂NO	Nitrosamide	nh2no
988	CH₂O₂	Dioxirane	diox
989	H₂COO	Dioxymethyl radical	h2coo
990	H₂COO⁺	dioxymethyl cation	h2coo+
991	HCOOH	Formic acid	ch2o2
992	H₂O₃	Hydrogen trioxide	h2o3
993	HSSSH	trisulfane	hsssh
994	NaOCH₃	Sodium methoxide	naoch3
995	CH₂BOH	hydroxy(methylene)borane	ch2boh
996	BH₃CO	Borane carbonyl	bh3co
997	CH₃BO	Borane, methyloxo-	ch3bo
998	CH₂CHO	Vinyloxy radical	ch2cho
999	CH₂COH⁺	ketene, protonated	ch2coh+
1000	CH₃CO	Acetyl radical	ch3co
1001	CH₃CO^-	Acetyl anion	ch3co-
1002	CH₃CO⁺	acetyl cation	ch3co+
1003	CH₂NOH	formaldoxime	ch2noh
1004	CH₃NO	nitrosomethane	ch3no
1005	CHONH₂	formamide	formamide
1006	CNOH₃	1,2-oxaziridine	cnoh3
1007	HOCHNH	hydroxymethylimine	hochnh
1008	CHSNH₂	thioformamide	chsnh2
1009	NHCHSH	Methanimidothioic acid	nhchsh
1010	CH₂OOH	CH2OOH radical	ch2ooh
1011	CH₃OO	methylperoxy radical	ch3oo
1012	CH₃OO^-	methylperoxy anion	ch3oo-
1013	CH₃OO⁺	methylperoxy cation	ch3oo+
1014	C₂H₄O	Ethylene oxide	c2h4o
1015	C₂H₄O⁺	ethylene oxide cation	c2h4o+
1016	CH₂CHOH	ethenol	ch2choh
1017	CH₃CHO	Acetaldehyde	ch3cho
1018	CH₃CHO⁺	acetaldehyde cation	ch3cho+
1019	H₂COCH₂⁺	Methyl, (methyleneoxoniumyl)-	h2coch2+
1020	C₂H₄S	Thiirane	thiirane
1021	CH₂CHSH	Ethenethiol	ch2chsh
1022	CH₃CHS	Thioacetaldehyde	ch3chs
1023	H₂CONH₂⁺	protonated formamide	h2conh2+
1024	NH₂CHOH⁺	Formamide, O-protonated	nh2choh+
1025	NH₃CHO⁺	Formamide, N-Protonated	nh3cho+
1026	CH₂(OH)₂	methanediol	ch2o2h2
1027	CH₃OOH	Methyl peroxide	ch3ooh
1028	CH₃SSH	Hydrogen methyl disulfide	ch3ssh
1029	HSCH₂SH	Methanedithiol	ch4s2
1030	H₂OH₂CO	water formaldehyde dimer	h2oh2co
1031	C₂H₄OH⁺	ethylene oxide, protonated	c2h4oh+
1032	CH₂CH₂OH	2-hydroxy ethyl radical	ch2ch2oh
1033	CH₃CH₂O	Ethoxy radical	ethoxy
1034	CH₃CHOH	1-hydroxy-ethyl radical	ch3choh
1035	CH₃CHOH⁺	acetaldehyde, protonated	ch3choh+
1036	CH₃OCH₂	methoxymethyl radical	ch3och2
1037	NH₂CH₂OH	aminomethanol	nh2ch2oh
1038	CH₃CH₂OH	Ethanol	etoh
1039	CH₃OCH₃	Dimethyl ether	meome
1040	CH₃CH₂SH	ethanethiol	etsh
1041	CH₃SCH₃	Dimethyl sulfide	mesme
1042	CH₃SCH₃⁺	dimethyl sulfide cation	mesme+
1043	CH₃SeCH₃	dimethylselenide	dmse
1044	CH₃OHH₂O	methanol water dimer	ch3ohh2o
1045	H₂OCH₃OH	water methanol dimer	h2och3oh
1046	CuF₂	Copper difluoride	cuf2
1047	ZnF₂	Zinc difluoride	znf2
1048	CNF	iso cyanogen fluoride	cnf
1049	FCN	Cyanogen fluoride	fcn
1050	ClCN	chlorocyanogen	clcn
1051	BrCN	Cyanogen bromide	brcn
1052	ICN	Cyanogen iodide	icn
1053	FBO	Boron monofluoride monoxide	fbo
1054	BeF₂	Beryllium fluoride	bef2
1055	MgF₂	Magnesium fluoride	mgf2
1056	BeCl₂	Beryllium chloride	becl2
1057	MgCl₂	Magnesium dichloride	mgcl2
1058	CaCl₂	Calcium Chloride	cacl2
1059	ZnCl₂	Zinc dichloride	zncl2
1060	BeBr₂	Beryllium bromide	bebr2
1061	CaBr₂	Calcium dibromide	cabr2
1062	CaF₂	Calcium difluoride	caf2
1063	FCO	Carbonyl fluoride	fco
1064	FCO⁺	Carbonyl fluoride cation	fco+
1065	ClCO	carbonyl monochloride	clco
1066	BF₂	Boron difluoride radical	bf2
1067	FNO	Nitrosyl fluoride	fno
1068	FNS	Thionitrosyl fluoride	fns
1069	FSN	Thiazyl fluoride	fsn
1070	BrNO	Nitrosyl bromide	brno
1071	INO	Nitrosyl iodide	ino
1072	CF₂	Difluoromethylene	cf2
1073	CF₂^-	Difluoromethylene anion	cf2-
1074	CF₂⁺	Difluoromethylene cation	cf2+
1075	CFCl	chlorofluoromethylene	cfcl
1076	SiF₂⁺	Silicon difluoride cation	sif2+
1077	CCl₂	dichloromethylene	ccl2
1078	CCl₂^-	dichloromethylene anion	ccl2-
1079	CCl₂⁺	dichloromethylene cation	ccl2+
1080	SiCl₂	Dichlorosilylene	sicl2
1081	GeF₂	Germanium difluoride	gef2
1082	GeCl₂	Germanium dichloride	gecl2
1083	CBr₂	dibromomethylene	cbr2
1084	FOO	Dioxygen monofluoride radical	foo
1085	FOO⁺	Fluorine dioxide cation	foo+
1086	ClOO	chloroperoxy radical	cloo
1087	ClOO⁺	chloroperoxy cation	cloo+
1088	OClO^-	Chlorine dioxide anion	oclo-
1089	OClO⁺	Chlorine dioxide cation	oclo+
1090	ClS₂	Sulfur chloride	cls2
1091	BrOO	Bromine dioxide	broo
1092	OBrO	Bromine dioxide radical	obro
1093	NF₂	Difluoroamino radical	nf2
1094	NF₂⁺	Difluoroamino cation	nf2+
1095	PF₂	Phosphorus difluoride	pf2
1096	PF₂⁺	Phosphorus difluoride cation	pf2+
1097	F₂O	Difluorine monoxide	f2o
1098	SF₂^-	sulfur difluoride anion	sf2-
1099	SF₂⁺	sulfur difluoride cation	sf2+
1100	Cl₂O	Dichlorine monoxide	cl2o
1101	SCl₂	Sulfur dichloride	scl2
1102	SeF₂	Selenium difluoride	sef2
1103	BrOCl	Bromine hypochlorite	brocl
1104	SeCl₂	Selenium Dichloride	secl2
1105	SBr₂	Sulfur dibromide	sbr2
1106	SeBr₂	Selenium dibromide	sebr2
1107	BrOBr	Bromine oxide	brobr
1108	F₃^-	trifluoride anion	f3-
1109	Cl₃^-	trichloride anion	cl3-
1110	Br₃^-	tribromide anion	br3-
1111	I₃^-	triiodide	i3-
1112	SFCl	Sulfur chloride fluoride	sfcl
1113	HCCF	Fluoroacetylene	hccf
1114	HCCF⁺	fluoroacetylene cation	hccf+
1115	HCCCl	Chloroacetylene	hcccl
1116	HCCBr	bromoacetylene	hccbr
1117	HFCO	formyl fluoride	hfco
1118	HFCO⁺	formyl fluoride cation	hfco+
1119	COHCl	Formyl chloride	cohcl
1120	COHBr	Formyl bromide	cohbr
1121	BHF₂	Difluoroborane	bhf2
1122	BHCl₂	Borane, dichloro-	bhcl2
1123	CHCl₂	dichloromethyl radical	chcl2
1124	CHF₂	difluoromethyl radical	chf2
1125	CHF₂⁺	difluoromethyl cation	chf2+
1126	CHFCl	Chlorofluoromethyl radical	chfcl
1127	CHFCl⁺	Chlorofluoromethyl cation	chfcl+
1128	CHCl₂⁺	dichloromethyl cation	chcl2+
1129	CHBr₂	dibromomethyl radical	chbr2
1130	HOClO	Chlorous acid	hoclo
1131	NHF₂	difluoramine	nhf2
1132	NHCl₂	dichloroamine	nhcl2
1133	CH₂F₂	Methane, difluoro-	ch2f2
1134	CH₂FCl	fluorochloromethane	ch2fcl
1135	CH₂Cl₂	Methylene chloride	ch2cl2
1136	CH₂BrF	Methane, bromofluoro-	ch2fbr
1137	CH₂BrCl	Methane, bromochloro-	ch2clbr
1138	CH₂FI	fluoroiodomethane	ch2fi
1139	CH₂Br₂	dibromomethane	ch2br2
1140	CH₂ClI	chloroiodomethane	ch2cli
1141	CH₂BrI	bromoiodomethane	ch2bri
1142	CH₂I₂	Diiodomethane	ch2i2
1143	CH₃MgBr	Methyl Magnesium Bromide	ch3mgbr
1144	CH₂CHF	Ethene, fluoro-	ch2chf
1145	CH₂CHF⁺	fluoroethene cation	ch2chf+
1146	C₂H₃Cl	Ethene, chloro-	ch2chcl
1147	C₂H₃Br	vinyl bromide	c2h3br
1148	C₂H₃I	Vinyl iodide	c2h3i
1149	CH₂FOH	fluoromethanol	ch2foh
1150	CH₃OCl	methyl hypochlorite	ch3ocl
1151	CH₂CH₂Cl	2-chloroethyl radical	ch2ch2cl
1152	CHClCH₃	1-chloroethyl radical	chclch3
1153	C₂H₅F	fluoroethane	c2h5f
1154	CH₃CH₂Cl	Ethyl chloride	c2h5cl
1155	CH₃SiFH₂	fluoromethylsilane	ch3sifh2
1156	C₂H₅Br	Ethyl bromide	etbr
1157	C₂H₅I	Ethyl iodide	c2h5i
1158	KrF₂	Krypton difluoride	krf2
1159	XeF₂	Xenon difluoride	xef2
1160	B₄H₁₀	Tetraborane(10)	b4h10
1161	C₄	Carbon tetramer	c4
1162	C₄⁺	Carbon tetramer cation	c4+
1163	C₄H₂	Diacetylene	c4h2
1164	C₄H₂⁺	diacetlyene cation	c4h2+
1165	C₂H₃CCH	1-Buten-3-yne	c2h3cch
1166	C₄H₄	cyclobutadiene	cbd
1167	C₄H₄	Tetrahedrane	c4h4
1168	H₂CCCCH₂	Butatriene	h2cccch2
1169	C₄H₆	1-Methylcyclopropene	c3100047
1170	C₄H₆	Cyclobutene	c822355
1171	C₄H₆	Methylenecyclopropane	c6142730
1172	CH₂CCHCH₃	1,2-Butadiene	butad12
1173	CH₂CHCHCH₂	1,3-Butadiene	c106990
1174	CH₃CCCH₃	2-Butyne	c503173
1175	CHCCH₂CH₃	1-Butyne	c107006
1176	CH₃CHCHCH₂	methylallyl radical	c4h7
1177	C₄H₈	methylcyclopropane	mcp
1178	CH₂C(CH₃)CH₃	1-Propene, 2-methyl-	isobute
1179	CH₂CHCH₂CH₃	1-Butene	bute1
1180	CH₃CHCHCH₃	2-Butene, (E)-	bute2e
1181	CH₃CHCHCH₃	2-Butene, (Z)-	bute2z
1182	B(CH₃)₃	trimethylborane	bme3
1183	Al(CH₃)₃	trimethyl aluminum	tma
1184	C(CH₃)₃	Tert-butyl radical	tbutyl
1185	CH₂CH(CH₃)₂	Isobutyl radical	isobutyl
1186	CH₃CHCH₂CH₃	2-Butyl radical	butyl2
1187	CH₃CH(CH₃)CH₃	Isobutane	isobutane
1188	CH₃CH₂CH₂CH₃	Butane	butane
1189	SiH(CH₃)₃	trimethylsilane	trimsi
1190	Li₃N	trilithium nitride	li3n
1191	C₂N₂	Cyanogen	c2n2
1192	C₂N₂⁺	Cyanogen cation	c2n2+
1193	P₄	Phosphorus tetramer	p4
1194	As₄	Arsenic tetramer	as4
1195	HCCCN	Cyanoacetylene	hcccn
1196	HCCCN⁺	Cyanoacetylene cation	hcccn+
1197	H₂CNCN	cyanamide, methylene	ch2ncn
1198	HNCCNH	Ethenediimine	hnccnh
1199	C₃H₃N	acrylonitrile	ch2chcn
1200	C₃H₃N⁺	acrylonitrile cation	ch2chcn+
1201	CH₃N₃	methyl azide	ch3n3
1202	NH₂CCNH₂	Diaminoacetylene	daa
1203	NH₂CH₂CN	Aminoacetonitrile	aan
1204	CH₃NHN₂⁺	methyl azide, protonated	ch3nhn2+
1205	C₂H₅CN	ethyl cyanide	c2h5cn
1206	CH₅N₃	Guanidine	guanidine
1207	C₄H₆	Bicyclo[1.1.0]butane	c157335
1208	CH₃NNCH₃	(Z)-1,2-Dimethyldiazene	dmdiazz
1209	H₂NCHCHNH₂	diaminoethylene	dae
1210	CH₆N₃⁺	guanidinium	ch6n3+
1211	C₃H₇N	Cyclopropylamine	cpram
1212	CH₇N₃	triaminomethane	tam
1213	C₃H₇N	Azetidine	azet
1214	C₄H₈	cyclobutane	cbutane
1215	C₂H₈N₂	Ethylenediamine	ethdiam
1216	CH₃NHNHCH₃	dimethyl hydrazine	dmh
1217	CH₃CH(NH₂)CH₃	2-Propanamine	pram2
1218	N(CH₃)₃	Trimethylamine	trimeam
1219	NH₂CH₂CH₂CH₃	1-Propanamine	pram1
1220	P(CH₃)₃	trimethylphosphine	tmp
1221	N(SiH₃)₃	trisilylamine	tsa
1222	As(CH₃)₃	trimethyl arsine	tmas
1223	(CH₃)₃NH⁺	protonated trimethyl amine	ptma
1224	C₃H₇NH₃⁺	n-propylamine, protonated	c3h7nh2
1225	Li₂O₂	dilithium dioxide	li2o2
1226	Na₂O₂	disodium dioxide	na2o2
1227	K₂O₂	dipotassium dioxide	k2o2
1228	C₃O	Tricarbon monoxide	c3o
1229	B₂O₂	Diboron dioxide	b2o2
1230	ONNO	NO dimer	onno
1231	CO₃	Carbon trioxide	co3
1232	CO₃^--	carbonate	co3--
1233	CS₃^--	Carbonotrithioate	cs3--
1234	NO₃	Nitrogen trioxide	no3
1235	NO₃^-	nitrate anion	no3-
1236	NO₃⁺	nitrogen trioxide cation	no3+
1237	SO₃^-	Sulfur trioxide anion	so3-
1238	SO₃^--	Sulfate dianion	so3--
1239	SO₃⁺	Sulfur trioxide cation	so3+
1240	SeO₃	selenium trioxide	seo3
1241	S₄	Sulfur tetramer	s4
1242	TeO₃	Tellurium trioxide	teo3
1243	HCO₃^-	bicarbonate anion	hco3-
1244	HNO₃	Nitric acid	hno3
1245	HSO₃	Hydroxysulfonyl radical	hso3
1246	NH₂NO₂	nitramide	nh2no2
1247	C₂H₂CO	cyclopropenone	c2h2co
1248	C₃H₂O	Propadienal	c3h2o
1249	HCCCHO	2-propynal	hcccho
1250	C₂H₂O₂	Ethanedial	c2h2o2
1251	C₂H₂O₂⁺	Ethanedial cation	c2h2o2+
1252	H₂CO₃	Carbonic acid	h2co3
1253	H₂CS₃	thiocarbonic acid	h2cs3
1254	H₂NO₃⁺	Nitric Acid, Protonated	h2no3+
1255	H₂SO₃	Sulfurous acid	h2so3
1256	C₂H₃NO	Nitrosoethylene	c2h3no
1257	CH₃NCO	methylisocyante	ch3nco
1258	HOCH₂CN	cyanomethanol	hoch2cn
1259	CH₃COO^-	acetate anion	ch3coo-
1260	CH₃NO₂	Methane, nitro-	ch3no2
1261	CH₃ONO	Methyl nitrite	ch3ono
1262	NH₂COOH	Carbamic acid	nh2cooh
1263	H₃BO₃	Boric acid	h3bo3
1264	H₃AlO₃	Aluminum hydroxide	h3alo3
1265	H₃CO₃⁺	carbonic acid, protonated	h3co3+
1266	C₃H₄O	2-Propyn-1-ol	c107197
1267	C₃H₄O	allenol	c9000071
1268	C₃H₄O	Cyclopropanone	cpone
1269	C₃H₄O	Methylketene	c6004440
1270	CH₂CHCHO	Acrolein	c3h4o
1271	NH₂CONH₂	Urea	urea
1272	NH₂CONH₂⁺	Urea cation	urea+
1273	NH₂CSNH₂	Thiourea	thiourea
1274	C₂H₄O₂	1,3-dioxetane	c2h4o2
1275	CH₃COOH	Acetic acid	ch3cooh
1276	CH₃OCHO	methyl formate	ch3ocho
1277	CHOCH₂OH	hydroxy acetaldehyde	haa
1278	NH₂COOH₂⁺	Carbamic acid, O-protonated	nh2cooh2+
1279	NH₃COOH⁺	protonated Carbamic acid	nh3cooh+
1280	H₂OHCOOH	Water formic acid dimer 1	h2ohcooh_10
1281	H₂OHCOOH	Water formic acid dimer 2	h2ohcooh_11
1282	HCOOHH₂O	Formic acid water dimer	hcoohh2o
1283	HOCH₂OOH	hydroxy methyl peroxide	hoch2ooh
1284	CH₃COCH₂	Acetonyl radical	ch3coch2
1285	CH₂C(OH)NH₂	1-amino vinyl alchohol	ava
1286	CH₃C(OH)=NH	Ethaninidic acid	eia
1287	CH₃CHNOH	Acetaldoxime	acetaldoxime
1288	CH₃CONH₂	Acetamide	acetamide
1289	HCONHCH₃	N-methylformamide	nmfa
1290	CH₃CSNH₂	Ethanethioamide	ch3csnh2
1291	CH₅N₂O⁺	urea, N-protonated	ch4n2o+
1292	H₂NCOHNH₂⁺	urea, protonated	ureah+
1293	C₂H₅OO	ethylperoxy radical	c2h5oo
1294	CH₃NNCH₃	(E)-1,2-Dimethyldiazene	dmdiaze
1295	C₃H₅OH	Cyclopropanol	cproh
1296	C₃H₆O	2-Propen-1-ol	c107186
1297	C₃H₆O	Acetone enol	enol
1298	C₃H₆O	Oxetane	oxetane
1299	C₃H₆O	Propylene oxide	prox
1300	CH₃CH₂CHO	Propanal	propanal
1301	CH₃COCH₃	Acetone	acetone
1302	CH₃COCH₃^-	acetone anion	ch3coch3-
1303	C₃H₆S	Thietane	thietane
1304	C₃H₆S	Thiirane, methyl-	methiirane
1305	CH₃CSCH₃	Thioacetone	ch3csch3
1306	C₂H₆O₂	1,2-Ethanediol	ethdiol
1307	CH₃OOCH₃	dimethylperoxide	dmp
1308	CH₃SOCH₃	Dimethyl sulfoxide	dmso
1309	CH₂SHCH₂SH	1,2-Ethanedithiol	ethdisl
1310	CH₃SSCH₃	Disulfide, dimethyl	ch3ssch3
1311	CH₃COHCH₃⁺	acetone, protonated	acetoneh+
1312	HOCH₂CH₂NH₂	monoethanolamine	mea
1313	C₃H₇OH	1-Propanol	proh
1314	CH₃CHOHCH₃	Isopropyl alcohol	isoproh
1315	CH₃OC₂H₅	Ethane, methoxy-	etome
1316	C₃H₇SH	1-Propanethiol	prsh
1317	CH₃CHSHCH₃	2-Propanethiol	isoprsh
1318	CH₃SCH₂CH₃	Ethane, (methylthio)-	etsme
1319	H₂OCH₃OCH₃	water dimethylether dimer	h2och3och3
1320	Li₂F₂	Lithium fluoride dimer	li2f2
1321	Na₂F₂	Sodium Fluoride Dimer	na2f2
1322	Na₂Cl₂	Disodium dichloride	na2cl2
1323	C₂F₂	difluoroacetylene	c2f2
1324	C₂Cl₂	dichloroacetylene	c2cl2
1325	C₂Cl₂⁺	dichloroacetylene cation	c2cl2+
1326	FNO₂	Nitryl fluoride	fno2
1327	FONO	Nitrosyl hypofluorite	fono
1328	ClNO₂	Nitryl chloride	clno2
1329	ClONO	chlorine nitrite	clono
1330	BrONO	Bromine nitrite	brono
1331	N₂F₂	(Z)-Difluorodiazene	n2f2_z
1332	N₂F₂	Dinitrogen difluoride, (E)-	n2f2_e
1333	CF₂O	Carbonic difluoride	f2co
1334	CF₂O⁺	Carbonic difluoride cation	f2co+
1335	COFCl	Carbonic chloride fluoride	cofcl
1336	CCl₂O	Phosgene	cl2co
1337	Cl₂CS	Thiophosgene	cl2cs
1338	COBr₂	Carbonic dibromide	cobr2
1339	BF₃	Borane, trifluoro-	bf3
1340	BF₃^-	Borane, trifluoro- anion	bf3-
1341	BF₃⁺	boron trifluoride cation	bf3+
1342	AlF₃	Aluminum trifluoride	alf3
1343	BClF₂	Chlorodifluoroborane	bclf2
1344	AlF₂Cl	Aluminum chloride difluoride	alclf2
1345	ScF₃	Scandium trifluoride	ScF3
1346	AlFCl₂	Aluminum dichloride fluoride	alcl2f
1347	BCl₃	Borane, trichloro-	bcl3
1348	BCl₃⁺	Boron Trichloride cation	bcl3+
1349	GaF₃	Gallium trifluoride	gaf3
1350	AlCl₃	Aluminum trichloride	alcl3
1351	GaCl₃	Gallium trichloride	gacl3
1352	BBr₃	Boron tribromide	bbr3
1353	AlBr₃	Aluminum Bromide	albr3
1354	ClO₃	Chlorine trioxide	clo3
1355	ClO₃^-	chlorate anion	clo3-
1356	BrO₃^-	Bromate anion	bro3-
1357	CF₃	Trifluoromethyl radical	cf3
1358	CF₃^-	Trifluoromethyl anion	cf3-
1359	CF₃⁺	Trifluoromethyl cation	cf3+
1360	CF₂Cl	difluorochloromethyl radical	cf2cl
1361	SiF₃	Silicon trifluoride radical	sif3
1362	SiF₃⁺	Silicon trifluoride cation	sif3+
1363	CFCl₂	dichlorofluoromethyl radical	cfcl2
1364	CCl₃	Trichloromethyl radical	ccl3
1365	CCl₃^-	Trichloromethyl anion	ccl3-
1366	CCl₃⁺	Trichloromethyl cation	ccl3+
1367	SiCl₃	trichlorosilyl radical	sicl3
1368	SiCl₃⁺	trichlorosilyl cation	sicl3+
1369	CBr₃	tribromomethyl radical	cbr3
1370	FOOF	Perfluoroperoxide	foof
1371	F₂SO	Thionyl Fluoride	f2so
1372	ClOOCl	Dichlorine dioxide	cloocl
1373	FSSF	Difluorodisulfane	fssf
1374	S₂F₂	Thio-thionyl fluoride	s2f2
1375	SOCl₂	thionyl chloride	socl2
1376	SSCl₂	Thiothionyl chloride	sscl2
1377	SeOCl₂	selenium oxychloride	seocl2
1378	NF₃	Nitrogen trifluoride	nf3
1379	NF₃^-	Nitrogen trifluoride anion	nf3-
1380	NF₃⁺	Nitrogen trifluoride cation	nf3+
1381	PF₃	Phosphorus trifluoride	pf3
1382	NCl₃	nitrogen trichloride	ncl3
1383	AsF₃	Arsenic trifluoride	asf3
1384	PCl₃	Phosphorus trichloride	pcl3
1385	SbF₃	Antimony Trifluoride	sbf3
1386	AsCl₃	Arsenous trichloride	ascl3
1387	SbCl₃	Antimony Trichloride	sbcl3
1388	NBr₃	Nitrogen Tribromide	nbr3
1389	PBr₃	Phosphorus tribromide	pbr3
1390	AsBr₃	Arsenic tribromide	asbr3
1391	NI₃	Nitrogen triiodide	ni3
1392	PI₃	Phosphorus triiodide	pi3
1393	ClSSCl	Disulfur dichloride	s2cl2
1394	SF₃	Sulfur trifluoride	sf3
1395	BrF₃	Bromine trifluoride	brf3
1396	IF₃	iodone trifluoride	if3
1397	HClO₃	Chloric Acid	hclo3
1398	CHF₃	Methane, trifluoro-	chf3
1399	CHF₂Cl	difluorochloromethane	chf2cl
1400	CHFCl₂	fluorodichloromethane	chfcl2
1401	CDCl₃	trichloromethane-d	cdcl3
1402	CHCl₃	Chloroform	chcl3
1403	CHBrF₂	Methane, bromodifluoro-	chbrf2
1404	SiHCl₃	Trichlorosilane	sihcl3
1405	CHFClBr	fluorochlorobromomethane	chfclbr
1406	CHBrCl₂	Methane, bromodichloro-	chbrcl2
1407	CHF₂I	difluoroiodomethane	chf2i
1408	CHBr₂F	dibromofluoromethane	chbr2f
1409	CHFClI	fluorochloroiodomethane	chfcli
1410	CHCl₂I	dichloroiodomethane	chcl2i
1411	CHClBr₂	Methane, dibromochloro-	chclbr2
1412	CHBr₃	bromoform	chbr3
1413	CHI₃	Iodoform	chi3
1414	NF₃H⁺	protonated nitrogen trifluoride	nf3h+
1415	AsF₃H⁺	Arsenic trifluoride, protonated	asf3h+
1416	C₂H₂F₂	Ethene, 1,2-difluoro-, (E)-	c2h2f2e
1417	C₂H₂F₂	Ethene, 1,2-difluoro-, (Z)-	c2h2f2z
1418	CH₂CF₂	Ethene, 1,1-difluoro-	ch2cf2
1419	C₂H₂ClF	1-chloro-1-fluoroethylene	c2h2clf
1420	CHFCHCl	(E)-1-chloro-2-fluoroethene	chfchcle
1421	CHFCHClz	(Z)-1-Chloro-2-fluoroethene	chfchclz
1422	CH₂CCl₂	Ethene, 1,1-dichloro-	ch2ccl2
1423	CHClCHCl	Ethene, 1,2-dichloro-, (E)-	chclchcle
1424	CHClCHCl	Ethene, 1,2-dichloro-, (Z)-	chclchclz
1425	C₂H₂Br₂	1,1-dibromoethene	c2h2br2
1426	CHBrCHBr	Ethene, 1,2-dibromo-, (E)-	chbrchbre
1427	CHBrCHBr	Ethene, 1,2-dibromo-, (Z)-	chbrchbrz
1428	CH₂FCHO	Fluoroacetaldehyde	ch2fcho
1429	CH₃COF	Acetyl fluoride	ch3cof
1430	CH₂ClCHO	chloroacetaldehyde	ch2clcho
1431	CH₃COCl	Acetyl Chloride	ch3cocl
1432	C₂H₄F₂	1,2-difluoroethane	c2h4f2
1433	CH₃CHF₂	Ethane, 1,1-difluoro-	ch3chf2
1434	CH₂FCH₂Cl	Ethane, 1-chloro-2-fluoro-	ch2fch2cl
1435	CH₃CHFCl	Ethane, 1-chloro-1-fluoro-	ch3chfcl
1436	CH₂ClCH₂Cl	Ethane, 1,2-dichloro-	ch2clch2cl
1437	CH₃CHCl₂	Ethane, 1,1-dichloro-	ch3chcl2
1438	CH₂BrCH₂Cl	1-bromo-2-chloroethane	ch2brch2cl
1439	CH₂BrCH₂Br	Ethane, 1,2-dibromo-	ch2brch2br
1440	CH₂CFCH₃	2-fluoropropene	2fpro
1441	CH₂CHCH₂F	Allyl Fluoride	allylf
1442	CH₃CHCHF	trans-1-Fluoro-1-propene	propene1ft
1443	C₃H₅Cl	1-Propene, 3-chloro-	prop1cl3
1444	C₃H₅Cl	1-chloro-1-propene(E)	prop1cl1e
1445	C₃H₅Cl	1-chloro-1-propene(Z)	prop1cl1z
1446	CH₂FCH₂OH	2-fluoroethanol	ch2fch2oh
1447	CH₂ClCH₂OH	2-Chloroethanol	ch2clch2oh
1448	CH₂ClCH₂OH₂⁺	2-chloroethanol, protonated	ch2clch2oh2+
1449	CH₂FCH₂CH₃	1-Fluoropropane	prf1
1450	CH₃CHFCH₃	2-Fluoropropane	prf2
1451	CH₂ClCH₂CH₃	Propane, 1-chloro-	prcl1
1452	CH₃CHClCH₃	Propane, 2-chloro-	prcl2
1453	CH₃CH₂CH₂Br	n-propyl bromide	prbr
1454	CH₃CHBrCH₃	i-propyl bromide	iprbr
1455	C₃H₉O⁺	trimethyl oxonium cation	c3h9o+
1456	B₅H₉	pentaborane9	b5h9
1457	C₅H₄	pentatetraene	ptrene
1458	C₅H₅	cyclopentadienyl radical	c5h5
1459	C₅H₅^-	cylopentadienyl anion	c5h5-
1460	C₅H₆	1,3-Cyclopentadiene	c542927
1461	C₅H₆	1-Buten-3-yne, 2-methyl-	c78808
1462	C₅H₆	3-Penten-1-yne, (E)-	c2004695
1463	C₅H₆	3-Penten-1-yne, (Z)-	c1574409
1464	C₅H₆	Bicyclo[2.1.0]pent-2-ene	c5164352
1465	C₅H₆	Cyclopropylacetylene	c6746947
1466	C₅H₆	Propellane	propellane
1467	C₅H₇	1,3-pentadienyl radical	pdyl
1468	C₅H₇	cyclopentenyl radical	cpyl
1469	C₅H₈	1,2-Butadiene, 3-methyl-	c598254
1470	C₅H₈	1,2-Pentadiene	c591957
1471	C₅H₈	1,3-Butadiene, 2-methyl-	c78795
1472	C₅H₈	1,3-Pentadiene, (E)-	c2004708
1473	C₅H₈	1,3-Pentadiene, (Z)-	c1574410
1474	C₅H₈	1,4-Pentadiene	c591935
1475	C₅H₈	1-pentyne	a1pentyne
1476	C₅H₈	2,3-Pentadiene	c591968
1477	C₅H₈	Bicyclo[1.1.1]pentane	bcp
1478	C₅H₈	Cyclobutane, methylene-	c1120565
1479	C₅H₈	Cyclopentene	c142290
1480	C₅H₈	Ethenylcyclopropane	c693867
1481	CH₃CCCH₂CH₃	2-Pentyne	2pentyne
1482	C₅H₁₀	1-Butene, 2-methyl-	c563462
1483	C₅H₁₀	2-Butene, 2-methyl-	c513359
1484	C₅H₁₀	2-Pentene, (E)-	c646048
1485	C₅H₁₀	2-Pentene, (Z)-	c627203
1486	C₅H₁₀	Cyclopentane	c287923
1487	C₅H₁₀	Cyclopropane, 1,1-dimethyl-	c1630940
1488	CH₂CHCH₂CH₂CH₃	1-pentene	pentene
1489	C₅H₁₁	2-Methylbut-2-yl radical	c4348350
1490	C₅H₁₂	Butane, 2-methyl-	buta2
1491	C₅H₁₂	Pentane	pentane
1492	C₅H₁₂	Propane, 2,2-dimethyl-	neopentane
1493	Si(CH₃)₄	tetramethylsilane	tms
1494	N₂O₃	Dinitrogen trioxide	n2o3
1495	C₃H₂N₂	Malononitrile	c3h2n2
1496	CH₂N₄	1H-Tetrazole	1htz
1497	C₃H₃N₂	imidazolyl radical	im
1498	C₃H₃N₂^-	imidizolyl anion	im-
1499	C₂H₃N₃	1H-1,2,4-Triazole	c288880
1500	C₄H₄N	pyrrolide radical	c4h4n
1501	C₄H₄N^-	pyrrolide anion	c4h4n-
1502	C₃H₄N₂	1H-Imidazole	1himidaz
1503	C₃H₄N₂	1H-Pyrazole	1hpyraz
1504	C₃H₄N₂	2H-Imidazole	imid2h
1505	C₃H₄N₂	4H-Imidazole	imid4h
1506	C₄H₅N	(E)-2-Butenenitrile	c627269
1507	C₄H₅N	(Z)-2-Butenenitrile	c1190767
1508	C₄H₅N	2H-pyrrole	pyrrole2
1509	C₄H₅N	3H-pyrrole	pyrrole3
1510	C₄H₅N	Cyclopropanecarbonitrile	c5500210
1511	C₄H₅N	Pyrrole	pyrrole
1512	CH₂CHCH₂CN	Allylcyanide	ch2chch2cn
1513	C₄H₆N⁺	pyrrole, alpha-protonated	appyr
1514	C₄H₆N⁺	pyrrole, beta-protonated	bppyr
1515	C₄H₆N⁺	pyrrole, protonated	ppyr
1516	C₃H₆N₂	3-Aminopropionitrile	c151188
1517	CH₃CH(CH₃)CN	Propanenitrile, 2-methyl-	c4h7n
1518	CH₃CH₂CH₂CN	Butanenitrile	c109740
1519	C₅H₈	Bicyclo[2.1.0]pentane	c185944
1520	C₅H₈	Spiropentane	c157404
1521	C₄H₉N	Cyclobutylamine	cbam
1522	C₄H₉N	Pyrrolidine	pyrrolidine
1523	C₃H₁₀N₂	1,2-Diaminopropane	diampr12
1524	C(CH₃)₃NH₂	2-Propanamine, 2-methyl-	c75649
1525	C(NH₂)H₂C(CH₃)HCH₃	1-Propanamine, 2-methyl-	c78819
1526	C(NH₂)H₂CH₂CH₂CH₃	1-Butanamine	butam1
1527	CH₃C(NH₂)HCH₂CH₃	2-Butanamine	butam2
1528	NH(C₂H₅)₂	diethylamine	dea
1529	NC₄H₁₂⁺	tetramethyl ammonium cation	nc4h12+
1530	C₃O₂	Carbon suboxide	c3o2
1531	C₃O₂⁺	Carbon suboxide cation	c3o2+
1532	B₂O₃	diboron trioxide	b2o3
1533	MgCO₃	Magnesium Carbonate	mgco3
1534	BeCO₃	Beryllium Carbonate	beco3
1535	CaCO₃	Calcium Carbonate	caco3
1536	ONONO	Nitrosyl nitrite	onono
1537	PO₄^---	phosphate	po4---
1538	SO₄^--	sulfate	so4--
1539	HOONO₂	peroxy nitric acid	hoono2
1540	HSO₄^-	bisulfate anion	hso4-
1541	C₂H₂N₂S	1,3,4-Thiadiazole	c2h2n2s
1542	C₃H₂O₂	Propiolic acid	c3h2o2
1543	CHOCOOH	oxo acetic acid	oaa
1544	CHOOCHO	diformyl ether	choocho
1545	H₂SO₄	Sulfuric acid	h2so4
1546	H₂SeO₄	Selenic acid	h2seo4
1547	C₃H₃NO	Isoxazole	isox
1548	C₃H₃NO	Oxazole	oxazole
1549	C₃H₃NS	Thiazole	thiazole
1550	CH₃C(O)OO	acetyl peroxy radical	ch3coo2
1551	CH₃NO₃	Methyl nitrate	ch3no3
1552	H₃PO₄	Phosphoric Acid	h3po4
1553	C₄H₄O	Furan	furan
1554	C₄H₄O⁺	Furan cation	furan+
1555	CH₃COCCH	3-butyn-2-one	c1423605
1556	C₄H₄S	Thiophene	furans
1557	C₄H₄Se	selenophene	c4h4se
1558	C₃H₄O₂	β–Propiolactone	beta
1559	C₃H₄O₂	2-Propenoic acid	propenoic2
1560	C₃H₄O₂	Methyl glyoxal	megly
1561	C₃H₄O₂	propanedial	propanedial
1562	C₃H₄O₂	propenalol	propenalol
1563	HOCHCCHOH	allenediol	aldiol
1564	C₂H₄O₃	1,2,3-trioxolane	c2h4o3
1565	C₂H₄O₃	trioxolane124	triox
1566	HOCH₂COOH	Hydroxyacetic acid	hac
1567	CH₂CHCONH₂	Acrylamide	c79061
1568	CH₃OCH₂CN	Methoxyacetonitrile	c1738369
1569	CH₅N₃S	Hydrazinecarbothioamide	c79196
1570	H₂NCH₂COOH	Glycine	glycine
1571	CH₃SO₂NH₂	methanesulfonamide	ch3so2nh2
1572	C₄H₆O	cis-2-butenal	butenal2c
1573	C₄H₆O	Cyclobutanone	cbutone
1574	C₄H₆O	Furan, 2,3-dihydro-	furan23h
1575	C₄H₆O	Furan, 2,5-dihydro-	furan25h
1576	CH₂CHOCHCH₂	Vinyl ether	vinylether
1577	CHOCHCHCH₃	2-Butenal	butenal2
1578	C₄H₆S	Thiophene, 2,3-dihydro-	thiop23h
1579	C₄H₆S	Thiophene, 2,5-dihydro-	thiop25h
1580	CH₂CHSCHCH₂	Divinyl sulfide	divis
1581	C₂H₆N₂O	Urea, methyl-	c598505
1582	C₃H₆O₂	1,3-Dioxolane	dioxolane
1583	CH₃CH₂COOH	Propanoic Acid	propanoic
1584	CH₃COOCH₃	methyl acetate	aame
1585	HCOOC₂H₅	Ethyl formate	faee
1586	C₂H₆O₂S	Dimethyl sulfone	c67710
1587	CH₃SSSCH₃	dimethyl trisulfide	c2h6s3
1588	C₃H₇NO	dimethylformamide	dmf
1589	C₃H₇NO	Propanamide	propanam
1590	C₂H₃OC₂H₅	Ethene, ethoxy-	c109922
1591	C₄H₈O	Cyclobutanol	c2919235
1592	C₄H₈O	Furan, tetrahydro-	thf
1593	CH₂C(CH₃)OCH₃	1-Propene, 2-methoxy-	pre1meo2
1594	CH₃COCH₂CH₃	2-Butanone	buta2one
1595	CHOCH(CH₃)CH₃	Propanal, 2-methyl-	c78842
1596	CHOCH₂CH₂CH₃	Butanal	butanal
1597	C₄H₈S	Thiophene, tetrahydro-	tht
1598	C₃H₈O₂	1,3-Propanediol	c504632
1599	C₃H₈O₂	Hydroperoxide, 1-methylethyl	c3031752
1600	C₃H₈O₂	Methane, dimethoxy-	c109875
1601	C₃H₈O₂	Propylene glycol	c57556
1602	C₃H₈S₂	1,3-Propanedithiol	c109808
1603	C₄H₁₀O	1-Butanol	butanol1
1604	C₄H₁₀O	1-Propanol, 2-methyl-	c78831
1605	C₄H₁₀O	2-Butanol, (.+/-.)-	butanol2
1606	C₄H₁₀O	Ethanol, 1,1-dimethyl-	tbuoh
1607	C₄H₁₀O	Ethoxy ethane	etoet
1608	C₄H₁₀O	Methyl propyl ether	meopr
1609	C₄H₁₀O	Propane, 2-methoxy-	c598538
1610	C₄H₁₀O⁺	1-Butanol cation	butanol1+
1611	C(CH₃)₃SH	2-Propanethiol, 2-methyl-	tbush
1612	C₂H₅SC₂H₅	Diethyl sulfide	etset
1613	C₄H₉SH	1-Butanethiol	bush
1614	CH₂(SH)CH(CH₃)CH₃	1-Propanethiol, 2-methyl-	c513440
1615	CH₃C(SCH₃)HCH₃	Propane, 2-(methylthio)-	mesipr
1616	CH₃CH(SH)CH₂CH₃	2-Butanethiol	butansl2
1617	FNO₃	Fluorine nitrate	fno3
1618	ClONO₂	Chlorine nitrate	clono2
1619	BrONO₂	Bromine nitrate	brono2
1620	TiCl₄	Titanium tetrachloride	ticl4
1621	ClO₄^-	perchlorate anion	clo4-
1622	BF₄^-	tetrafluoroboron anion	bf4-
1623	ClFO₃	Perchloryl fluoride	clfo3
1624	SO₂F₂	Sulfuryl fluoride	so2f2
1625	SO₂Cl₂	Sulfuryl chloride	so2cl2
1626	F₃NO	Nitrogen trifluoride oxide	f3no
1627	F₃PO	Phosphoryl fluoride	pf3o
1628	Cl₃PO	Phosphoryl chloride	pcl3o
1629	CF₄	Carbon tetrafluoride	cf4
1630	CF₃Cl	Methane, chlorotrifluoro-	cf3cl
1631	SiF₄	Silicon tetrafluoride	sif4
1632	CF₂Cl₂	difluorodichloromethane	cf2cl2
1633	TiF₄	Titanium tetrafluoride	tif4
1634	CFCl₃	Trichloromonofluoromethane	cfcl3
1635	CF₃Br	Bromotrifluoromethane	cf3br
1636	GeF₄	Germanium tetrafluoride	gef4
1637	CCl₄	Carbon tetrachloride	ccl4
1638	CCl₄⁺	Carbon tetrachloride cation	ccl4+
1639	CBrClF₂	Methane, bromochlorodifluoro-	cbrclf2
1640	SiCl₄	Silane, tetrachloro-	sicl4
1641	CBrCl₂F	bromodichlorofluoromethane	cbrcl2f
1642	CF₃I	trifluoroiodomethane	cf3i
1643	CBrCl₃	Methane, bromotrichloro-	cbrcl3
1644	CBr₂F₂	Methane, dibromodifluoro-	cbr2f2
1645	GeCl₄	Germanium Tetrachloride	gecl4
1646	CBr₂ClF	dibromochlorofluoromethane	cbr2clf
1647	CBr₂Cl₂	dibromodichloromethane	cbr2cl2
1648	CCl₃I	trichloroiodomethane	ccl3i
1649	CFBr₃	fluorotribromomethane	cfbr3
1650	CFClBrI	fluorochlorobromoiodomethane	cfclbri
1651	CBr₃Cl	tribromochloromethane	cbr3cl
1652	CF₂I₂	difluorodiiodomethane	cf2i2
1653	CBr₄	Carbon tetrabromide	cbr4
1654	CCl₂I₂	dichlorodiiodomethane	ccl2i2
1655	SiBr₄	Silicon tetrabromide	sibr4
1656	CBr₃I	tribromoiododmethane	cbr3i
1657	GeBr₄	Germanium tetrabromide	gebr4
1658	CI₄	tetraiodomethane	ci4
1659	SiI₄	silicon tetraiodide	sii4
1660	ClOF₃	Chlorine trifluoride oxide	clof3
1661	SF₄	Sulfur tetrafluoride	sf4
1662	SeF₄	Selenium tetrafluoride	sef4
1663	SCl₄	Sulfur tetrachloride	scl4
1664	C₂HF₃	Trifluoroethylene	c2hf3
1665	C₂HF₃⁺	Trifluoroethylene cation	c2hf3+
1666	CHClCCl₂	Trichloroethylene	chclccl2
1667	CHBrCF₂	1-Bromo-2,2-difluoroethylene	chbrcf2
1668	HClO₄	perchloric acid	hclo4
1669	HSO₃F	Fluorosulfonic acid	hso3f
1670	CF₃OH	trifluoromethanol	cf3oh
1671	CH₂ClCCCl	1,3-dichloropropyne	ch2clcccl
1672	CHClCCHCl	1,3-dichloroallene	chclcchcl
1673	CHCl₂CCH	3,3-dichloropropyne	chcl2cch
1674	CHCl₂CHO	dichloroacetaldehyde	chcl2cho
1675	PF₃CH₂	phosphorane, trifluoromethylene-	pf3ch2
1676	CH₃CF₃	Ethane, 1,1,1-trifluoro-	ch3cf3
1677	CHF₂CH₂F	Ethane, 1,1,2-trifluoro	ch2fchf2
1678	CH₃CF₂Cl	1-Chloro-1,1-Difluoroethane	ch3cf2cl
1679	CH₃CFCl₂	1,1-Dichloro-1-fluoroethane	ch3cfcl2
1680	CH₂ClCHCl₂	1,1,2-trichloroethane	ch2clchcl2
1681	CH₃CCl₃	Ethane, 1,1,1-trichloro-	ch3ccl3
1682	SiCl₃CH₃	methyltrichlorosilane	sicl3ch3
1683	CH₃CBr₃	1,1,1-tribromoethane	ch3cbr3
1684	NH₃BCl₃	Amminetrichloroboron	nh3bcl3
1685	SiH₃CCl₃	(trichloromethyl)silane	sih3ccl3
1686	CH₂CClCHCH₂	1,3-Butadiene, 2-chloro-	c4h5cl
1687	C₃H₅ClO	Oxirane, (chloromethyl)-	c106898
1688	CH₂FCH₂CH₂F	1,3-difluoropropane	ch2fch2ch2f
1689	CH₃CF₂CH₃	2,2-difluoropropane	ch3cf2ch3
1690	CH₂ClCH₂CH₂Cl	1,3-dichloropropane	prdicl13
1691	CH₂ClCHClCH₃	Propane, 1,2-dichloro-	prdicl12
1692	CH₃CCl₂CH₃	Propane, 2,2-dichloro-	prdicl22
1693	CHCl₂CH₂CH₃	1,1-dichloropropane	prdicl11
1694	SiCl₂(CH₃)₂	dichlorodimethylsilane	sicl2me2
1695	CH₂CClCH₂CH₃	1-Butene, 2-chloro-	bute1cl2
1696	CH₂CHCH₂CH₂Cl	1-Butene, 4-chloro-	bute1cl4
1697	CH₂CHCHClCH₃	1-Butene, 3-chloro-	bute1cl3
1698	CH₂ClCHCHCH₃	2-Butene, 1-chloro-	bute2cl1
1699	CH₃CClCHCH₃	2-Butene, 2-chloro-, (E)-	bute2cl2e
1700	CH₃CClCHCH₃	2-Butene, 2-chloro-, (Z)-	bute2cl2z
1701	CHClCHCH₂CH₃	(E)-1-Chloro-1-butene	bute1cl1
1702	CHClCHCH₂CH₃	(Z)-1-Chloro-1-butene	bute1cl1z
1703	C₄H₉F	1-fluorobutane	butaf1
1704	CH₃CHFCH₂CH₃	2-fluorobutane	butaf2
1705	CH₂ClCH₂CH₂CH₃	Butane, 1-chloro-	butacl1
1706	CH₃CCl(CH₃)CH₃	Propane, 2-chloro-2-methyl-	procl2me2
1707	CH₃CHClCH₂CH₃	Butane, 2-chloro-	butacl2
1708	XeF₄	Xenon tetrafluoride	xef4
1709	C₂H₂N₂O	Furazan	furazan
1710	CF₃PH₂	phosphine, (trifluoromethyl)-	cf3ph2
1711	NH₃BF₃	Amminetrifluoroboron	nh3bf3
1712	C₆H₂	hexatriyne	c6h2
1713	C₆H₄	(E)-Hexa-1,5-diyne-3-ene	c6h4e
1714	C₆H₄	(Z)-Hexa-1,5-diyne-3-ene	c6h4z
1715	C₆H₄	Benzyne	benzyne
1716	C₆H₅	phenyl	phenyl
1717	C₆H₅^-	phenyl anion	phenyl-
1718	C₆H₆	Prismane	prismane
1719	C₆H₆	1,2,4,5-Hexatetraene	ht1245
1720	C₆H₆	2,4-Hexadiyne	hexadiyne
1721	C₆H₆	3,4-Dimethylenecyclobutene	cb34m
1722	C₆H₆	Benzene	benzene
1723	C₆H₆	Benzvalene	bv
1724	C₆H₆	Dewar Benzene	dewar
1725	C₆H₆	Hexa-1,5-diene-3-yne	hdy153
1726	C₆H₆	Trimethylenecycopropane	tmcp
1727	C₆H₆⁺	Benzene cation	c6h6+
1728	C₆H₇⁺	benzene, protonated	c6h7+
1729	C₆H₈	(E)-hexa-1,3,5-triene	c821078
1730	C₆H₈	(E)-hexa-2,3,4-triene	c59660650
1731	C₆H₈	(Z)-hexa-1,3,5-triene	hexatri135
1732	C₆H₈	(Z)-hexa-2,3,4-triene	hetr234c
1733	C₆H₈	1,3-Cyclohexadiene	cyhexadiene13
1734	C₆H₈	1,4-Cyclohexadiene	cyhexadiene14
1735	C₆H₈	3-Methylenecyclopentene	c930267
1736	C₆H₈	Bicyclo[2.1.1]hex-2-ene	c822413
1737	C₆H₈	Bicyclo[2.2.0]hex-1(4)-ene	c30830207
1738	C₆H₈	Bicyclo[3.1.0]hex-2-ene	c694019
1739	C₆H₁₀	1,3-Hexadiene, (E)-	hexdi13e
1740	C₆H₁₀	1,3-Hexadiene, (Z)-	hexdi13z
1741	C₆H₁₀	1,4-Hexadiene, (E)-	hexdi14t
1742	C₆H₁₀	1,4-Hexadiene, (Z)-	hexdi14z
1743	C₆H₁₀	1,5-Hexadiene	c592427
1744	C₆H₁₀	1-Butyne, 3,3-dimethyl-	c917920
1745	C₆H₁₀	1-Hexyne	hexyne1
1746	C₆H₁₀	2,4-Hexadiene, (E,E)-	hexdi24ee
1747	C₆H₁₀	2,4-Hexadiene, (E,Z)-	hexdi24ez
1748	C₆H₁₀	2,4-Hexadiene, (Z,Z)-	hexdi24zz
1749	C₆H₁₀	2-Hexyne	c764352
1750	C₆H₁₀	3-Hexyne	hexyne3
1751	C₆H₁₀	cyclohexene	cyclohexene
1752	C₆H₁₀	Cyclopentene, 1-methyl-	c693890
1753	C₆H₁₀	Cyclopentene, 3-methyl-	c1120623
1754	C₆H₁₀	Cyclopentene, 4-methyl-	c1759815
1755	C₄H₆(CH₃)₂	1,1-dimethylcyclobutane	dmcb11
1756	C₆H₁₂	(1R,2R)-1,2-dimethylcyclobutane	dmcb12t
1757	C₆H₁₂	(1r,3r)-1,3-dimethylcyclobutane	dmcb13t
1758	C₆H₁₂	(E)-2-Hexene	e2hexene
1759	C₆H₁₂	(E)-3-methylpent-2-ene	c616126
1760	C₆H₁₂	(E)-hex-3-ene	e3hexene
1761	C₆H₁₂	(Z)-3-methylpent-2-ene	c922623
1762	C₆H₁₂	(Z)-hex-2-ene	z2hexene
1763	C₆H₁₂	(Z)-hex-3-ene	z3hexene
1764	C₆H₁₂	2,3-dimethylbut-1-ene	c563780
1765	C₆H₁₂	2,3-dimethyl-but-2-ene	tmeet
1766	C₆H₁₂	3-methylenepentane	c760214
1767	C₆H₁₂	cis-1,2-dimethylcyclobutane	dmcb12c
1768	C₆H₁₂	cis-1,3-dimethylcyclobutane	dmcb13c
1769	C₆H₁₂	Cyclohexane	cyclohexane
1770	C₆H₁₂	Cyclopentane, methyl-	c96377
1771	C₆H₁₂	Ethylcyclobutane	c4806615
1772	C₆H₁₂	hex-1-ene	hexene1
1773	C₆H₁₄	Butane, 2,2-dimethyl-	buta22
1774	C₆H₁₄	Butane, 2,3-dimethyl-	buta23
1775	C₆H₁₄	Hexane	hexane
1776	C₆H₁₄	Pentane, 2-methyl-	penta2
1777	C₆H₁₄	Pentane, 3-methyl-	penta3
1778	C₄N₂	2-Butynedinitrile	c4n2
1779	N₃P₃	1,3,5,2,4,6-Triazatriphosphorine	n3p3
1780	C₄H₂N₂	Fumaronitrile	c4h2n2
1781	C₂H₂N₄	sym-tetrazine	ttz
1782	C₃H₃N₃	1,3,5-Triazine	triazine135
1783	CH₃N₅	5-Aminotetrazole	c4418615
1784	C₄H₄N₂	1,3-Diazine	diazine13
1785	C₄H₄N₂	Pyrazine	pyrazine
1786	C₄H₄N₂	Pyridazine	pyridazine
1787	C₄H₄N₂	Succinonitrile	c110612
1788	C₂H₄N₄	1H-Tetrazole, 1-methyl-	c16681779
1789	C₂H₄N₄	1H-Tetrazole, 5-methyl-	c4076362
1790	C₂H₄N₄	2H-Tetrazole, 2-methyl-	c16681780
1791	C₅H₅N	Bicyclo[1.1.0]butane-1-carbonitrile	bibucn
1792	C₅H₅N	E-2,4-pentadienenitrile	bdcn
1793	C₅H₅N	Pyridine	pyridine
1794	B₃N₃H₆	borazine	borazine
1795	C₆H₆	Fulvene	fulvene
1796	C₅H₆N⁺	Pyridinium	c5h6n
1797	C₄H₆N₂	1H-Imidazole, 2-methyl-	c693981
1798	C₅H₇N	(E)-2-Pentenenitrile	c26294984
1799	C₅H₇N	(E)-3-Pentenenitrile	c16529661
1800	C₅H₇N	(Z)-2-Pentenenitrile	c25899507
1801	C₅H₇N	1H-Pyrrole, 1-methyl-	c96548
1802	C₅H₇N	Cyclobutanecarbonitrile	c4426113
1803	C₅H₉N	1,2,3,6-Tetrahydropyridine	c694053
1804	C₅H₉N	Butanenitrile, 2-methyl-	c18936179
1805	C₅H₉N	Pentanenitrile	c110598
1806	C₅H₉N	Propanenitrile, 2,2-dimethyl-	c630182
1807	C₆H₁₀	Bicyclo[3.1.0]hexane	c285585
1808	C₅H₁₁N	Cyclopentanamine	cypentam
1809	C₅H₁₁N	Piperidine	piper
1810	C₄H₁₂N₂	1,2-Butanediamine	c4426486
1811	C₄H₁₂N₂	2-Methyl-1,2-propanediamine	c811938
1812	Li₂CO₃	Lithium Carbonate	li2co3
1813	Na₂CO₃	Sodium Carbonate	na2co3
1814	C₂O₄^--	oxalate anion	c2o4
1815	MgSO₄	Magnesium Sulfate	mgso4
1816	N₂O₄	Dinitrogen tetroxide	n2o4
1817	C₃H₂O₃	vinylene carbonate	vica
1818	C₂H₂O₄	Oxalic Acid	oxalic
1819	C₂H₃NO₃	Oxamic acid	oxamic
1820	C₄H₄O₂	2(5H)-Furanone	furanone
1821	C₄H₄O₂	2-Oxetanone, 4-methylene-	c674828
1822	C₂H₄N₂O₂	Oxalamide	oxalamide
1823	C₂H₄N₂S₂	Ethanedithioamide	c79403
1824	C₂H₄CO₃	Ethylene carbonate	etco3
1825	C₃H₄O₂S	2H-Thiete-1,1-dioxide	c7285327
1826	C₃H₄S₃	1,3-Dithiolane-2-thione	c822388
1827	C₂H₄O₄	Formic acid dimer	fadimer
1828	C₄H₅NO	3-Methylisoxazole	isox3m
1829	C₄H₅NO	Isoxazole, 5-methyl-	c5765446
1830	C₄H₅NS	4-Methylthiazole	c693958
1831	C₂H₅NO₃	Nitric acid, ethyl ester	c625581
1832	C₅H₆O	2H-Pyran	pyran2
1833	C₅H₆O	2-methylfuran	furan2m
1834	C₅H₆O	3-Methylfuran	furan3m
1835	C₅H₆O	Pentadienal	pdal
1836	C₅H₆S	Thiophene, 2-methyl-	c554143
1837	C₅H₆S	Thiophene, 3-methyl-	c616444
1838	C₄H₆O₂	γ–Butyrolactone	c96480
1839	C₄H₆O₂	2,3-Butanedione	c431038
1840	C₄H₆O₂	2-Propenoic acid, methyl ester	c96333
1841	C₄H₆O₂	Crotonic Acid	crot
1842	C₄H₆OS	2,3-dihydrothiophene-2-ol	c9000117
1843	C₄H₆OS	2,5-dihydrothiophene-3-ol	c9000093
1844	C₄H₆OS	4,5-dihydrothiophene-2-ol	c9000106
1845	C₄H₆OS	4,5-dihydrothiophene-3-ol	c9000082
1846	C₄H₆OS	Dihydro-2-(3H)-thiophenone	c1003107
1847	C₄H₆OS	Dihydro-3-(2H)-thiophenone	c1003049
1848	C₄H₆OS	Vinyl sulfoxide	c1115157
1849	CH₆N₄S	Carbonothioic dihydrazide	thiacarb
1850	C₂H₆N₂O₂	(E)-Azodioxymethane	c37765154
1851	C₂H₆N₂O₂	Dimethylnitroamine	c4164287
1852	C₃H₆O₃	1,3,5-Trioxane	trioxane
1853	C₃H₆S₃	1,3,5-Trithiane	c3h6s3
1854	C₃H₆S₃	Carbonotrithioic acid, dimethyl ester	c2314489
1855	C₂H₆O₃S	Sulfurous acid, dimethyl ester	c616422
1856	C₄H₇NO	2-Pyrrolidinone	c616455
1857	C₄H₇NO	Ethoxyacetonitrile	etoaccn
1858	C₄H₇NO	Methacrylamide	c79390
1859	C₄H₇NO	Oxazole, 4,5-dihydro-2-methyl-	c1120645
1860	HCONH₂CN₂H₄	formamide aminomethanimine dimer	d13
1861	C₃H₇ONO	Propyl nitrite	prono
1862	CH₃CH(CH₃)ONO	Isopropyl nitrite	c541424
1863	CH₃CH(NH₂)COOH	Alanine	alanine
1864	CH₃NHCH₂COOH	Sarcosine	sarcosine
1865	NH₂CH₂CH₂COOH	β–alanine	betaalanine
1866	NH₂COOC₂H₅	Urethane	urethane
1867	C₅H₈O	2H-Pyran, 3,4-dihydro-	c110872
1868	C₅H₈O	Cyclopentanone	c120923
1869	C₅H₈O	Furan, 2,3-dihydro-5-methyl-	c1487156
1870	C₅H₈O	Methyl cyclopropyl ketone	c765435
1871	N(CH₃)₂CONH₂	Urea, N,N-dimethyl-	c598947
1872	NH(CH₃)CONH(CH₃)	Urea, N,N'-dimethyl-	c96311
1873	NH₂CONHC₂H₅	Urea, ethyl-	c625525
1874	C₄H₈O₂	1,3-Dioxane	dioxan13
1875	C₄H₈O₂	1,3-Dioxolane, 2-methyl-	c497267
1876	C₄H₈O₂	1,4-Dioxane	dioxan14
1877	C₄H₈O₂	Ethene, 1,1-dimethoxy-	c922690
1878	C₄H₈O₂	Ethyl acetate	c141786
1879	C₄H₈OS	s-Ethyl thioacetate	c625605
1880	C₃H₈O₃	1,2,3-Propanetriol	glycerin
1881	C₃H₈O₂S	(Methylsulfonyl)ethane	c594434
1882	C₄H₉NO	Butanamide	c541355
1883	C₄H₉NO	Propanamide, 2-methyl-	c563837
1884	C₅H₁₀O	2-Butanone, 3-methyl-	c563804
1885	C₅H₁₀O	2H-Pyran, tetrahydro-	c142687
1886	C₅H₁₀O	2-methylbutyraldehyde	2meba
1887	C₅H₁₀O	2-Pentanone	mpk
1888	C₅H₁₀O	3-Pentanone	dek
1889	C₅H₁₀O	Cyclopentanol	c96413
1890	C₅H₁₀O	Oxetane, 3,3-dimethyl-	c6921353
1891	C₅H₁₀O	Pentanal	pal
1892	C₅H₁₀S	2H-Thiopyran, tetrahydro-	c1613510
1893	C₅H₁₀S	3-Ethylthio-1-propene	c5296628
1894	C₅H₁₀S	Cyclopentanethiol	c1679078
1895	C₅H₁₀S	Thiophene, tetrahydro-2-methyl-	c1795091
1896	C₅H₁₀S	Thiophene, tetrahydro-3-methyl-	c4740005
1897	C₄H₁₀O₂	1,1-Dimethoxyethane	c534156
1898	C₄H₁₀O₂	1,3-Butanediol	budiol13
1899	C₄H₁₀O₂	1,4-Butanediol	budiol14
1900	C₄H₁₀O₂	Ethane, 1,2-dimethoxy-	c110714
1901	C₄H₁₀OS	Diethyl sulfoxide	c70291
1902	C₄H₁₀S₂	1,4-Butanedithiol	budisl14
1903	C₄H₁₁NO	Diethylhydroxylamine	c3710847
1904	C₅H₁₂O	1-Butanol, 2-methyl-	c137326
1905	C₅H₁₂O	1-Butanol, 3-methyl-	c123513
1906	C₅H₁₂O	1-Pentanol	pentanol1
1907	C₅H₁₂O	2-Butanol, 3-methyl-	c598754
1908	C₅H₁₂O	2-Pentanol	peol2
1909	C₅H₁₂O	3-Pentanol	pentan3ol
1910	C₅H₁₂O	Butane, 1-methoxy-	meobu
1911	C₅H₁₂O	Propane, 1-ethoxy-	proet
1912	C₅H₁₂O	Propane, 2-methoxy-2-methyl-	c1634044
1913	C₅H₁₂S	1-Butanethiol, 2-methyl-	c1878188
1914	C₅H₁₂S	1-Butanethiol, 3-methyl-	c541311
1915	C₅H₁₂S	1-Pentanethiol	c110667
1916	C₅H₁₂S	1-Propanethiol, 2,2-dimethyl-	c1679089
1917	C₅H₁₂S	2-Butanethiol, 2-methyl-	c1679090
1918	C₅H₁₂S	2-Butanethiol, 3-methyl-	c2084186
1919	C₅H₁₂S	Butane, 1-(methylthio)-	c628295
1920	C₅H₁₂S	Ethyl propyl sulfide	c4110503
1921	C₅H₁₂S	Propane, 2-(ethylthio)-	c5145993
1922	C₅H₁₂S	Propane, 2-methyl-2-(methylthio)-	c6163640
1923	C₄F₂	difluorobutadiyne	c4f2
1924	ClCOClCO	Oxalyl chloride	oxcl
1925	CF₃CN	Acetonitrile, trifluoro-	cf3cn
1926	CF₃CN⁺	Acetonitrile, trifluoro- cation	cf3cn+
1927	B₂F₄	Diboron tetrafluoride	b2f4
1928	B₂Cl₄	Diboron tetrachloride	b2cl4
1929	C₂F₄	Tetrafluoroethylene	c2f4
1930	C₂F₄⁺	Tetrafluoroethylene cation	c2f4+
1931	C₂ClF₃	Ethene, chlorotrifluoro-	c2f3cl
1932	CF₂CCl₂	difluorodichloroethylene	cf2ccl2
1933	CFClCClF	trans-1,2-dichloro-1,2-difluoroethylene	cfclcclf
1934	CFClCFCl	cis-1,2-dichloro-1,2-difluoroethylene	cfclcfcl
1935	C₂FCl₃	fluorotrichloroethene	c2fcl3
1936	C₂Cl₄	Tetrachloroethylene	c2cl4
1937	C₂Br₄	tetrabromoethene	c2br4
1938	CF₃OF	Trifluoromethylhypofluorite	cf3of
1939	SOF₄	Sulfur tetrafluoride oxide	sof4
1940	PF₅	Phosphorus pentafluoride	pf5
1941	AsF₅	Arsenic pentafluoride	asf5
1942	PCl₅	Phosphorus pentachloride	pcl5
1943	SF₅	Sulfur pentafluoride	sf5
1944	SF₅⁺	pentafluoro sulfur cation	sf5+
1945	SbCl₅	Antimony pentachloride	sbcl5
1946	BrF₅	bromine pentafluoride	brf5
1947	ClF₅	chlorinepentafluoride	clf5
1948	IF₅	pentafluoroiodine	if5
1949	CF₃CHO	trifluoroacetaldehyde	cf3cho
1950	CCl₃CHO	trichloroacetaldehyde	ccl3cho
1951	CHFClCHClF	ethane, 1,2-dichloro-1,2-difluoro-	chfclchclf
1952	CF₃CH₂F	1,1,1,2-tetrafluoroethane	cf3ch2f
1953	CHF₂CHF₂	1,1,2,2-tetrafluoroethane	chf2chf2
1954	CF₃CH₂Cl	2,2,2-Trifluoroethyl chloride	cf3ch2cl
1955	CHFClCHFCl	1,2-dichloro-1,2-difluoroethane RR	chfclchfcl
1956	CH₂ClCCl₃	1,1,1,2-tetrachloroethane	ch2clccl3
1957	CHCl₂CHCl₂	Ethane, 1,1,2,2-tetrachloro-	chcl2chcl2
1958	CH₂BrCBr₃	1,1,1,2-tetrabromo ethane	c2h2br4
1959	CHCl₂CHF₂	1,1-dichloro-2,2-difluoroethane	c2h2cl2f2
1960	CF₃COOH	trifluoroacetic acid	cf3cooh
1961	C₄H₃ClO	Furan, 2-chloro	fur2cl
1962	C₄H₃ClO	Furan,3-chloro	fur3cl
1963	C₃H₅ClO₂	Carbonochloridic acid, ethyl ester	c541413
1964	C₃H₅Cl₃	Propane, 1,2,3-trichloro-	prcl135
1965	C₄H₈Cl₂	1,4-Dichlorobutane	c110565
1966	C₄H₈Cl₂	Butane, 1,2-dichloro-	c616217
1967	C₄H₈Cl₂	Butane, 1,3-dichloro-	c1190223
1968	C₄H₈Cl₂	Butane, 2,3-dichloro-, (r,r)-(.+/-.)-	c2211678
1969	C₄H₈Cl₂	Butane, 2,3-dichloro-, (r,s)-	c4028562
1970	C₄H₉ClO	1-Chloro-2-ethoxyethane	c628342
1971	C₅H₁₁Cl	Pentane, 1-chloro-	pencl1
1972	C₄H₈O₂	Butanoic acid	bua
1973	C₆H₅CH₂	benzyl radical	benzyl
1974	C₇H₇	cycloheptatrienyl radical	c7h7
1975	C₇H₇⁺	cycloheptatrienyl cation	c7h7+
1976	C₆H₅CH₃	toluene	toluene
1977	C₇H₈	cycloheptatriene	cht
1978	C₇H₈	Norbornadiene	norbor
1979	C₇H₈	Quadricyclane	qucy
1980	C₇H₁₂	Norbornane	nor
1981	C₇H₁₄	cycloheptane	c7h14
1982	C₇H₁₆	2-methylhexane	2mhex
1983	C₇H₁₆	3-methylhexane	hex3m
1984	C₇H₁₆	heptane	heptane
1985	CH(CN)₃	tricyanomethane	mecn3
1986	HN=C=C(CN)₂	Dicyanoketenimine	c4hn3
1987	C₆H₇N	2-Methylpyridine	mp
1988	C₆H₅NH₂	aniline	aniline
1989	C₆H₁₃N	2-Methylpiperidine	pip2m
1990	C₆H₁₃N	cyclohexanamine	cham
1991	C₆H₁₅N	triethylamine	tea
1992	N₂O₅	Dinitrogen pentoxide	n2o5
1993	C₄H₂O₃	Maleic Anhydride	malan
1994	C₅H₄O₂	4-Cyclopentene-1,3-dione	cpdio
1995	C₅H₄O₂	furfural	furfural
1996	C₆H₅O	phenoxy radical	phenoxy
1997	C₅H₅NO	2(1H)-Pyridinone	c72762006
1998	C₅H₅NO	2(3H)-Pyridinone	c9000048
1999	C₅H₅NO	2(5H)-Pyridinone	c9000037
2000	C₅H₅NO	2-Pyridinol	c109104
2001	C₅H₅NO	3(2H)-Pyridinone	c9000004
2002	C₅H₅NO	3(4H)-Pyridinone	c9000026
2003	C₅H₅NO	3(6H)-Pyridinone	c9000015
2004	C₅H₅NO	3-Pyridinol	c109002
2005	C₅H₅NO	4(1H)-Pryidinone	c9000060
2006	C₅H₅NO	4(3H)-Pryidinone	c9000059
2007	C₅H₅NO	4-Pyridinol	c626642
2008	C₆H₅OH	phenol	phenol
2009	C₆H₆O	2,4-Cyclohexadienone	c24599573
2010	C₆H₆O	2,5-Cyclohexadienone	c5664335
2011	C₆H₅SH	Benzenethiol	phsh
2012	HO₂CCHNH₂CH₂OH	Serine	serine
2013	C₅H₈O₂	Acetylacetone	acac
2014	C₄H₈O₂S	Sulfolane	sulfolane
2015	C₇H₁₀	Norbornene	norbornene
2016	CH(C₂H₃)₃	trivinyl methane	tvm
2017	C₆H₁₀O	cyclohexanone	chexo
2018	C₆H₁₂O	hexanal	c6h12o
2019	C₆H₁₂O	Oxepane	oxepane
2020	C₃H₇OC₃H₇	di-n-propyl ether	propr
2021	F₂CCCF₂	tetrafluoroallene	pfa
2022	CF₃COO^-	trifluoro acetate anion	cf3coo-
2023	CF₃COF	trifluoroacetyl fluoride	cf3cof
2024	CF₃COCl	trifluoroacetyl chloride	cf3cocl
2025	PF₆	Hexafluorophosphate neutral	pf6
2026	PF₆^-	Hexafluorophosphate ion	pf6-
2027	SF₆	Sulfur Hexafluoride	sf6
2028	SeF₆	Selenium hexafluoride	sef6
2029	SF₅Cl	sulfur chloropentafluoride	sf5cl
2030	CF₃CHF₂	pentafluoroethane	cf3chf2
2031	CF₃CHFCl	1,1,1,2-tetrafluorochloroethane	cf3chfcl
2032	CF₃CHCl₂	1,1-Dichloro-2,2,2-trifluoroethane	cf3chcl2
2033	CHCl₂CClF₂	Ethane, 1,2,2-trichloro-1,1-difluoro-	chcl2cclf2
2034	CCl₃CHCl₂	pentachloroethane	ccl3chcl2
2035	C₆H₅F	Fluorobenzene	bzf
2036	C₆H₅Cl	chlorobenzene	bzcl
2037	C₆H₅Br	bromobenzene	bzbr
2038	C₈H₆	Calicene	calicene
2039	C₆H₅CCH	phenylacetylene	phac
2040	C₈H₆	benzocyclobutadiene	bcbd
2041	C₈H₆	Pentalene	pentalene
2042	C₆H₅CHCH₂	Styrene	styrene
2043	C₈H₈	cubane	cubane
2044	C₈H₈	cyclooctatetraene	cot
2045	C₆H₅CH₂CH₃	Ethylbenzene	etbz
2046	CH₃C₆H₄CH₃	meta-xylene	mxylene
2047	CH₃C₆H₄CH₃	paraxylene	pxylene
2048	C₈H₁₄	Bicyclo[2.2.2]octane	bico222
2049	C₈H₁₆	cyclooctane	cyclooct
2050	(CH₃)₃CC(CH₃)₃	tetramethylbutane	tmb
2051	C₈H₁₈	Octane	c8h18
2052	C₆H₅CN	phenyl cyanide	phcn
2053	C₆H₁₂N₂	Triethylenediamine	ted
2054	C₄O₄^--	squarate dianion	c4o4--
2055	S₄N₄	Tetrasulfur tetranitride	s4n4
2056	S₈	Octasulfur	s8
2057	C₆H₄O₂	parabenzoquinone	pbq
2058	C₄H₄N₂O₂	Uracil	uracil
2059	C₆H₅CHO	benzaldehyde	benzal
2060	C₆H₅OCH₃	Anisole	anisole
2061	C₅H₉NO₂	Proline	proline
2062	C₆H₁₂O₂	Methyl pivalate	c598981
2063	C₆H₁₂O₂	Hexanoic acid	hexa
2064	C₄F₄	tetrafluorcyclobutadiene	c4f4
2065	Al₂Cl₆	Aluminum, di-μ-chlorotetrachlorodi-	al2cl6
2066	CF₃CF₂Cl	pentafluorochloroethane	cf3cf2cl
2067	CF₂ClCF₂Cl	1,2-Dichloro-1,1,2,2-tetrafluoroethane	cf2clcf2cl
2068	CF₃CFCl₂	1,1-Dichlorotetrafluoroethane	cf3cfcl2
2069	CF₂ClCFCl₂	Ethane, 1,1,2-trichloro-1,2,2-trifluoro-	cf2clcfcl2
2070	CF₃CCl₃	1,1,1-trifluoro-2,2,2-trichloroethane	cf3ccl3
2071	C₂F₆	hexafluoroethane	c2f6
2072	C₂Cl₆	hexachloroethane	c2cl6
2073	IF₇	Iodine heptafluoride	if7
2074	C₆H₄F₂	metadifluorobenzene	mdfb
2075	C₆H₄F₂	orthodifluorobenzene	odfb
2076	C₆H₄F₂	1,4-difluorobenzene	pdfb
2077	C₆H₄Cl₂	1,2-dichlorobenzene	dcb12
2078	C₆H₄Cl₂	1,3-dichlorobenzene	dcb13
2079	C₆H₄Cl₂	1,4-dichlorobenzene	dcb14
2080	C₆H₅NO	nitrosobenzene	bzno
2081	C₉H₈	Indene	indene
2082	C₉H₈	spiro[4.4]nona-1,3,6,8-tetraene	snt
2083	C₉H₁₂	n-propyl benzene	prbz
2084	C₉H₂₀	Nonane	nonane
2085	C(CN)₄	tetracyanomethane	c5n4
2086	C₅H₄N₄	purine	purine
2087	C₈H₇N	Indole	indole
2088	C₃H₃N₃O₃	cyanuric acid	cyanuric
2089	C₆H₅NO₂	Nitrobenzene	c6h5no2
2090	C₆H₅COOH	benzoic acid	benzo
2091	CH₃COC₆H₅	acetophenone	acph
2092	C₃Cl₃N₃	1,3,5-Triazine, 2,4,6-trichloro-	c3cl3n3
2093	C₃F₆	hexafluoropropene	c3f6
2094	C₆H₃F₃	Benzene trifluoride 123	bzf3a
2095	C₈H₁₈O	1-Octanol	octanol
2096	C₁₀H₈	Azulene	azu
2097	C₁₀H₈	naphthalene	naph
2098	C₁₀H₁₀	bullvalene	bullv
2099	C₁₀H₁₆	adamantane	adamantane
2100	C₆N₄	Tetracyanoethylene	tcne
2101	C₆N₄^-	tetracyanoethylene anion	tcne-
2102	C₁₀H₂₂	Decane	decane
2103	C₄F₆	perfluorobutadiene	c4f6
2104	SF₅CF₃	Sulfur, pentafluoro(trifluoromethyl)-	sf5cf3
2105	C₃F₈	perfluoropropane	c3f8
2106	Fe(CO)₅	Iron pentacarbonyl	ipc
2107	Fe(C₅H₅)₂	ferrocene	fecp2
2108	B₁₂H₁₂^--	Dodecahydrododecaborate(2-)	b12h12--
2109	B₁₂H₁₂^--	Dodecahydrododecaborate(2-)	b12h12--
2110	C₁₂H₈	Acenaphthylene	acenaph
2111	C₁₂H₈	biphenylene	biph
2112	C₁₂H₁₀	biphenyl	biphenyl
2113	C₁₂H₁₀	Heptalene	heptalene
2114	C₆H₁₂O₆	Inositol	inositol
2115	C₆F₆	hexafluorobenzene	c6f6
2116	S₂F₁₀	disulphur decafluoride	s2f10
2117	C₁₃H₁₀	Fluorene	fluorene
2118	C₁₄H₁₀	Anthracene	anth
2119	C₁₄H₁₀	Phenanthrene	phenanthrene
2120	C₁₄H₁₄	Bibenzyl	bibenzyl
2121	C₁₂H₁₀N₂	azobenzene	azobenzene
2122	C₆H₅COC₆H₅	benzophenone	benzophenone
2123	C₁₆H₁₀	Pyrene	pyrene
2124	C₁₈H₁₂	Tetracene	tetracene
2125	C₁₉H₁₆	Triphenylmethane	tpm
2126	C₂₄H₁₂	Coronene	coronene
2127	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