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

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

count	Species	Name	State	Conformation
1	SiH	Silylidyne	²Π	C_∞v
2	SiH₃	Silyl radical	²A₁	C_3v
3	SiH₃⁺	Silyl cation	¹A₁^'	D_3h
4	PH₃	Phosphine	¹A₁	C_3v
5	H₂S	Hydrogen sulfide	¹A₁	C_2v
6	Ar	Argon atom	¹S	K_h
7	ArH⁺	Argon hydride cation	¹Σ	C_∞v
8	Li₂	Lithium diatomic	¹Σ_g	D_∞v
9	NaLi	lithium sodium	¹Σ	C_∞v
10	Na₂	Sodium diatomic	¹Σ_g	D_∞h
11	NaAl	Sodium aluminum	¹Σ	C_∞v
12	B₂	Boron diatomic	³Σ_g	D_∞h
13	B₂⁺	Boron diatomic cation	²Π	D_∞h
14	B₂H₄	Diborane(4) D2d	¹A₁	D_2d
15	HBHHBH	Diborane(4) C2V	¹A₁	C_2v
16	Si₂H₆	disilane	¹E_u	D_3d
17	SiN	Silicon nitride	²Σ	C_∞v
18	PN	Phosphorus mononitride	¹Σ	C_∞v
19	BH₃PH₃	borane phosphine
20	SiO	Silicon monoxide	¹Σ	C_∞v
21	NS	Mononitrogen monosulfide	²Π	C_∞v
22	PO	Phosphorus monoxide	²Π	C_∞v
23	O₂	Oxygen diatomic	³Σ_g	D_∞h
24	O₂^--	dioxygen dianion
25	SO	Sulfur monoxide	³Σ	C_∞v
26	SO	Sulfur monoxide	¹Σ	C_∞v
27	HBS	hydrogen boron sulfide	¹Σ	C_∞v
28	HNO	Nitrosyl hydride	¹A^'	C_s
29	HO₂	Hydroperoxy radical	²A^"	C_s
30	H₂CO	Formaldehyde	¹A₁	C_2v
31	H₂S₂	Disulfane	¹A	C₂
32	BF	Boron monofluoride	¹Σ	C_∞v
33	CF	Fluoromethylidyne	²Π	C_∞v
34	SiF	silicon monofluoride	²Π	C_∞v
35	SiF⁺	silicon monofluoride cation	¹Σ	C_∞v
36	ClO	Monochlorine monoxide	²Π	C_∞v
37	SF	Monosulfur monofluoride	²Π	C_∞v
38	SF⁺	sulfur monofluoride cation	³Σ	C_∞v
39	SCl⁺	sulfur monochloride cation	³Σ_g	C_∞v
40	Cl₂	Chlorine diatomic	¹Σ_g	D_∞h
41	HOF	Hypofluorous acid	¹A^'	C_s
42	HOCl	hypochlorous acid	¹A^'	C_s
43	CH₃Cl	Methyl chloride	¹A₁	C_3v
44	SiH₃F	monofluorosilane	¹A₁	C_3v
45	SiC₂	Silicon dicarbide
46	Si₃H₈	trisilane
47	NaCN	Sodium Cyanide	¹Σ	C_∞v
48	NaCN	Sodium Cyanide	¹A	C_s
49	NaCN	Sodium Cyanide	¹Σ	C_∞v
50	AlNC	Aluminum isocyanide
51	HCCN	cyanomethylene
52	Na₂S	Sodium sulfide
53	Na₂S	Sodium sulfide
54	N₂O	Nitrous oxide	¹Σ	C_∞v
55	SiS₂	Silicon disulfide	¹Σ_G	D_∞h
56	SO₂	Sulfur dioxide	¹A₁	C_2v
57	HCNO	fulminic acid	¹Σ	C_∞v
58	ClNO	Nitrosyl chloride	¹A^'	C_s
59	OPCl	Phosphorus oxychloride
60	CF₂	Difluoromethylene	¹A₁	D_∞h
61	SiF₂	Silicon difluoride	¹A₁	C_2v
62	FClO	chlorosyl fluoride	¹A^'	C_s
63	ClOF	Chlorine hypofluorite	¹A^'	C_s
64	SF₂	sulfur difluoride	¹A₁	C_2v
65	HCCF	Fluoroacetylene	¹Σ	C_∞v
66	CH₂F₂	Methane, difluoro-	¹A₁	C_2v
67	SiH₂F₂	difluorosilane
68	SiH₂Cl₂	dichlorosilane	¹A₁	C_2v
69	S₂N₂	Disulfur dinitride	¹A_G	D_2h
70	CF₂O	Carbonic difluoride	¹A₁	C_2v
71	ClO₂F	Chloryl fluoride	¹A^'	C_s
72	CHF₃	Methane, trifluoro-	¹A₁	C_3v
73	SiHF₃	trifluorosilane
74	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^-	silicon monohydride anion	sih-
124	SiH⁺	silicon monohydride cation	sih+
125	GeH	germylidene	geh
126	GeH⁺	Germaniun monohyrdide cation	geh+
127	CH₂	Methylene	ch2
128	CH₂^-	methylene anion	ch2-
129	CH₂⁺	methylene cation	ch2+
130	SiH₂	silicon dihydride	sih2
131	SiH₂^-	silicon dihydride anion	sih2-
132	SiH₂⁺	silicon dihydride cation	sih2+
133	GeH₂	germylene	geh2
134	GeH₂^-	germylene anion	geh2-
135	CH₃	Methyl radical	ch3
136	CH₃^-	methyl anion	ch3-
137	CH₃⁺	methyl cation	ch3+
138	SiH₃^-	Silyl anion	sih3-
139	GeH₃	Germyl radical	geh3
140	GeH₃⁺	germyl cation	geh3+
141	CD₄	methane-d4	cd4
142	CH₂D₂	methane-d2	ch2d2
143	CH₃D	methane-d	ch3d
144	CH₄	Methane	ch4
145	CH₄^-	Methane anion	ch4-
146	CH₄⁺	Methane cation	ch4+
147	CHD₃	methane-d3	chd3
148	SiH₂D₂	silane-d2	sih2d2
149	SiH₄	Silane	sih4
150	SiH₄⁺	Silane cation	sih4+
151	GeH₄	Germane	geh4
152	SnH₄	Stannane	snh4
153	SiH₅⁺	Silane, protonated	sih5+
154	N	Nitrogen atom	n
155	N^-	Nitrogen atom anion	n-
156	N⁺	Nitrogen atom cation	n+
157	P	Phosphorus atom	p
158	P^-	Phosphorus atom anion	p-
159	P⁺	Phosphorus atom cation	p+
160	V	Vanadium atom	v
161	V⁺	Vanadium atom cation	v+
162	As	Arsenic atomic	as
163	As^-	Arsenic anion	as-
164	As⁺	Arsenic cation	as+
165	Sb	Antimony atom	sb
166	NH	Imidogen	nh
167	NH^-	Imidogen anion	nh-
168	NH⁺	imidogen cation	nh+
169	PH	phosphorus monohydride	ph
170	PH^-	phosphorus monohydride anion	ph-
171	PH⁺	phosphorus monohydride cation	ph+
172	AsH	Arsenic monohydride	ash
173	AsH⁺	Arsenic monohydride cation	ash+
174	SbH	Antimony monohydride	sbh
175	ND₂	Amidogen-d2	nd2
176	NH₂	Amino radical	nh2
177	NH₂^-	amino anion	nh2-
178	NH₂⁺	Amino cation	nh2+
179	PH₂	Phosphino radical	ph2
180	PH₂^-	Phosphino anion	ph2-
181	PH₂⁺	Phosphino cation	ph2+
182	AsH₂	Arsenic dihydride	ash2
183	AsH₂⁺	Arsenic dihydride cation	ash2+
184	ND₃	Ammonia-d3	nd3
185	NH₃	Ammonia	nh3
186	NH₃^-	Ammonia anion	nh3-
187	NH₃⁺	ammonia cation	nh3+
188	PH₃⁺	Phosphine cation	ph3+
189	AsH₃	Arsine	ash3
190	AsH₃⁺	Arsine cation	ash3+
191	SbH₃	Stibine	sbh3
192	AsH₄⁺	Arsonium	ash4+
193	NH₄	Ammonium radical	nh4
194	NH₄⁺	ammonium cation	nh4+
195	PH₄	Phosphoranyl radical	ph4
196	PH₄⁺	phosphonium cation	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 anion	h2s-
230	H₂S⁺	Hydrogen sulfide cation	h2s+
231	H₂Se	Hydrogen selenide	h2se
232	H₂Se⁺	Hydrogen selenide cation	h2se+
233	H₂Te	Hydrogen Telluride	h2te
234	H₃O⁺	hydronium cation	h3o+
235	H₃S⁺	Sulfonium cation	h3s+
236	H₃Se⁺	Hydrogen Selenide, protonated	h3se+
237	F	Fluorine atom	f
238	F^-	Fluorine atom anion	f-
239	F⁺	Fluorine atom cation	f+
240	Cl	Chlorine atom	cl
241	Cl^-	Chlorine atom anion	cl-
242	Cl⁺	Chlorine atom cation	cl+
243	Mn	Manganese atom	mn
244	Br	Bromine atom	br
245	Br^-	Bromine atom anion	br-
246	Br⁺	Bromine atom cation	br+
247	I	Iodine atom	iodine
248	I^-	Iodine atom anion	iodine-
249	I⁺	Iodine atom cation	iodine+
250	DF	Hydrofluoric acid-d	df
251	HF	Hydrogen fluoride	hf
252	HF^-	hydrogen fluoride anion	hf-
253	HF⁺	hydrogen fluoride cation	hf+
254	DCl	Hydrochloric acid-d	dcl
255	HCl	Hydrogen chloride	hcl
256	HCl^-	hydrogen chloride anion	hcl-
257	HCl⁺	hydrogen chloride cation	hcl+
258	HBr	hydrogen bromide	hbr
259	HBr^-	hydrogen bromide anion	hbr-
260	HBr⁺	hydrogen bromide cation	hbr+
261	HI	Hydrogen iodide	hi
262	HI⁺	Hydrogen iodide cation	hi+
263	H₂F⁺	dihydrogen fluoride cation	h2f+
264	H₂Cl⁺	dihydrogen monochloride cation	h2cl+
265	H₂Br⁺	protonated hydrogen bromide	h2br+
266	H₂I⁺	Iodonium	h2i+
267	Ne	Neon atom	ne
268	Ne^-	Neon atom anion	ne-
269	Ne⁺	Neon atom cation	ne+
270	Ar^-	Argon atom anion	ar-
271	Ar⁺	Argon atom cation	ar+
272	Fe	Iron atom	fe
273	Kr	Krypton atom	kr
274	Kr⁺	Krypton cation	kr+
275	Xe	Xenon atom	xe
276	HeLi⁺	Helium Lithium cation	heli+
277	NeH	neon hydrogen	neh
278	NeH⁺	neon hydrogen cation	neh+
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 anion	li2-
285	Li₂⁺	lithium diatomic cation	li2+
286	NaLi^-	lithium sodium anion	lina-
287	NaLi⁺	lithium sodium cation	lina+
288	LiK	Lithium Potassium	lik
289	Na₂^-	sodium diatomic anion	na2-
290	Na₂⁺	sodium diatomic cation	na2+
291	NaK	Sodium Potassium	nak
292	NaK⁺	Sodium Potassium diatomic cation	nak+
293	K₂	Potassium diatomic	k2
294	Cu₂	Copper diatomic	cu2
295	LiBe	Lithium Beryllium	libe
296	LiMg	Lithium magnesium	limg
297	NaBe	Sodium Beryllium	nabe
298	NaMg	Sodium Magnesium	namg
299	Be₂	Beryllium diatomic	be2
300	Be₂^-	Beryllium diatomic anion	be2-
301	Be₂⁺	Beryllium diatomic cation	be2+
302	BeMg	Beryllium Magnesium	bemg
303	Mg₂	Magnesium diatomic	mg2
304	Mg₂^-	magnesium diatomic anion	mg2-
305	Mg₂⁺	magnesium diatomic cation	mg2+
306	Ca₂	Calcium diatomic	ca2
307	LiB	Lithium boride	lib
308	LiAl	Lithium Aluminum	lial
309	BeB	Beryllium monoboride	beb
310	B₂^-	Boron diatomic anion	b2-
311	BAl	Boron Aluminum	bal
312	Al₂	Aluminum diatomic	al2
313	Al₂^-	aluminum diatomic anion	al2-
314	Al₂⁺	aluminum diatomic cation	al2+
315	BGa	Boron Gallium	bga
316	AlGa	Aluminum Gallium	alga
317	Ga₂	Gallium diatomic	ga2
318	HBBH	Diborane(2)	hbbh
319	LiBH₄	Lithium borohydride	libh4
320	B₂H₆	Diborane	b2h6
321	B₂H₆⁺	Diborane cation	b2h6
322	Al₂H₆	dialane	al2h6
323	Ga₂H₆	digallane	ga2h6
324	LiC	Lithium Carbide	lic
325	BeC	Beryllium Carbide	bec
326	CaC	Calcium monocarbide	cac
327	BC	boron monocarbide	bc
328	BC^-	boron monocarbide anion	bc-
329	BC⁺	boron monocarbide cation	bc+
330	AlC	Aluminum carbide	alc
331	BSi	Boron silicide	bsi
332	C₂	Carbon diatomic	c2
333	C₂^-	carbon diatomic anion	c2-
334	C₂⁺	carbon diatomic cation	c2+
335	SiC	silicon monocarbide	sic
336	SiC^-	silicon monocarbide anion	sic-
337	SiC⁺	silicon monocarbide cation	sic+
338	Si₂	Silicon diatomic	si2
339	Si₂^-	silcon diatomic anion	si2-
340	Si₂⁺	silcon diatomic cation	si2+
341	GeC	Germanium monocarbide	gec
342	SiGe	Silicon Germanium	sige
343	Ge₂	Germanium diatomic	ge2
344	C₂H	Ethynyl radical	c2h
345	C₂H^-	Ethynyl anion	c2h-
346	C₂H⁺	Ethynyl cation	c2h+
347	ZnCH₂	Zinc methylene	znch2
348	C₂H₂	Acetylene	c2h2
349	C₂H₂⁺	acetylene cation	c2h2+
350	CCH₂	vinylidene	vinylidene
351	H₂CC^-	vinylidene anion	h2cc-
352	HCCH^-	acetylene anion	c2h2-
353	Si₂H₂	disilyne	si2h2
354	CH₃Li	methyl lithium	ch3li
355	CuCH₃	monomethyl copper	cuch3
356	ZnCH₃	Zinc monomethyl	znch3
357	CH₂BH	methyleneborane	ch2bh
358	C₂H₃	vinyl	c2h3
359	C₂H₃^-	vinyl anion	c2h3-
360	C₂H₃⁺	vinyl cation	c2h3+
361	C₂H₄	Ethylene	c2h4
362	C₂H₄^-	Ethylene anion	c2h4-
363	C₂H₄⁺	Ethylene cation	c2h4+
364	CH₃CH	methylmethylene	ch3ch
365	CH₂SiH₂	silaethylene	ch2sih2
366	Si₂H₄	Disilene	si2h4
367	CH₃BH₂	methylborane	ch3bh2
368	C₂H₅	Ethyl radical	c2h5
369	C₂H₅^-	Ethyl anion	c2h5-
370	C₂H₅⁺	Ethyl cation	c2h5+
371	C₂H₆	Ethane	c2h6
372	C₂H₆⁺	ethane cation	c2h6+
373	CH₃SiH₃	methyl silane	ch3sih3
374	GeH₃CH₃	methyl germane	geh3ch3
375	C₂H₇⁺	Ethane, protonated	c2h7+
376	LiN	Lithium Nitride	lin
377	LiN⁺	Lithium Nitride cation	lin+
378	LiP	Lithium monophosphide	lip
379	BeN	Beryllium mononitride	ben
380	BeN^-	Beryllium mononitride anion	ben-
381	BeN⁺	Beryllium mononitride cation	ben+
382	MgN	Magnesium Nitride	mgn
383	BN^-	boron nitride anion	bn-
384	AlN^-	aluminum mononitride anion	aln-
385	AlN⁺	aluminum mononitride cation	aln+
386	BP	Boron monophosphide	bp
387	AlP	Aluminum monophosphide	alp
388	GaN	Gallium mononitride	gan
389	GaP	Gallium monophosphide	gap
390	GaAs	Gallium arsenide	gaas
391	BN	boron nitride	bn
392	BN⁺	boron nitride cation	bn+
393	AlN	Aluminum nitride	aln
394	CN	Cyano radical	cn
395	CN^-	cyanide anion	cn-
396	CN⁺	Cyano cation	cn+
397	CP	Carbon monophosphide	cp
398	CP^-	carbon monophosphide anion	cp-
399	CP⁺	carbon monophosphide cation	cp+
400	SiN^-	silicon mononitride anion	sin-
401	SiN⁺	silicon mononitride cation	sin+
402	SiP	Silicon monophosphide	sip
403	SiP^-	Silicon monophosphide anion	sip-
404	SiP⁺	Silicon monophosphide cation	sip+
405	TiN	Titanium mononitride	tin
406	N₂	Nitrogen diatomic	n2
407	N₂^-	nitrogen diatomic anion	n2-
408	N₂⁺	diatomic nitrogen cation	n2+
409	PN^-	phosphorus nitride anion	pn-
410	PN⁺	phosphorus nitride cation	pn+
411	P₂	Phosphorus diatomic	p2
412	P₂^-	phosphorus diatomic anion	p2-
413	P₂⁺	phosphorus diatomic cation	p2+
414	AsN	Arsenic mononitride	asn
415	AsP	Arsenic monophosphide	asp
416	SbN	Antimony nitride	sbn
417	As₂	Arsenic diatomic	as2
418	HNB	hydrogen nitrogen boron	hnb
419	HNC	hydrogen isocyanide	hnc
420	HCN	Hydrogen cyanide	hcn
421	HCN^-	Hydrogen cyanide anion	hcn-
422	HCN⁺	hydrogen cyanide cation	hcn+
423	HNC⁺	hydrogen isocyanide cation	hnc+
424	HCP	Phosphaethyne	hcp
425	HCP⁺	Phosphaethyne cation	hcp+
426	NNH	Dinitrogen monohydride	nnh
427	NNH⁺	Dinitrogen monohydride cation	nnh+
428	HPO	Hydrogen phosphorus oxide	hpo
429	HPO⁺	Hydrogen phosphorus oxide cation	hpo+
430	LiNH₂	lithium amide	linh2
431	HBNH	Boranimine	hbnh
432	CNH₂	Aminomethylidyne radical	cnh2
433	CNH₂⁺	N-protonated hydrogen isocyanide	cnh2+
434	H₂CN	Dihydrogen cyanide radical	h2cn
435	H₂CN⁺	hydrocyanonium cation	h2cn+
436	HCNH	methyleneazane	hcnh
437	HCNH⁺	N-protonated HCN	hcnh+
438	H₂NN	Isodiazene	h2nn
439	N₂H₂	(E)-diazene	n2h2
440	N₂H₂	(Z)-Diazene	n2h2z
441	N₂H₂⁺	trans-diazene cation	n2h2+
442	CH₂NH	Methanimine	ch3n
443	CH₂NH⁺	Methanimine cation	ch2nh+
444	CHNH₂	aminomethylene	chnh2
445	CHNH₂⁺	Aminocarbene cation	chnh2+
446	CH₂PH	Phosphaethene	ch3p
447	BH₂NH₂	Boranamine	bh2nh2
448	CH₂NH₂⁺	methyleneamine cation	ch2nh2+
449	N₂H₄	Hydrazine	n2h4
450	N₂H₄⁺	hydrazine cation	n2h4+
451	P₂H₄	Diphosphine	p2h4
452	CH₃NH₂	methyl amine	ch3nh2
453	CH₃NH₂⁺	methyl amine cation	ch3nh2+
454	CH₃PH₂	Methyl phosphine	ch3ph2
455	SiH₃NH₂	Silane, amino	sih3nh2
456	N₂H₅⁺	protonated hydrazine	n2h5+
457	BH₃NH₃	borane ammonia	bh3nh3
458	CH₃NH₃	methyl ammonium radical	ch3nh3
459	CH₃NH₃⁺	protonated methylamine	ch3nh3+
460	CH₃PH₃⁺	methyl phosphine, protonated	ch3ph3+
461	NH₃NH₃	Ammonia Dimer	nh3nh3
462	N₂H₇⁺	ammonia ammonium dimer	n2h7+
463	LiO	lithium oxide	lio
464	LiO^-	lithium oxide anion	lio-
465	LiO⁺	lithium oxide cation	lio+
466	LiS	Lithium monosulfide	lis
467	LiS⁺	Lithium sulfide cation	lis+
468	NaO	sodium monoxide	nao
469	NaO^-	sodium oxide anion	nao-
470	NaO⁺	sodium oxide cation	nao+
471	KO	Potassium monoxide	ko
472	KO⁺	Potassium monoxide cation	ko+
473	NaS	Sodium sulfide	nas
474	CuO	Copper Monoxide	cuo
475	LiSe	Lithium monoselenide	lise
476	BeO	beryllium oxide	beo
477	BeO^-	Beryllium monoxide anion	beo-
478	BeO⁺	Beryllium monoxide cation	beo+
479	BeS	beryllium sulfide	bes
480	MgO	magnesium oxide	mgo
481	MgO^-	magnesium oxide anion	mgo-
482	MgO⁺	magnesium oxide cation	mgo+
483	CaO	Calcium monoxide	cao
484	MgS	magnesium sulfide	mgs
485	MgS^-	magnesium sulfide anion	mgs-
486	MgS⁺	magnesium sulfide cation	mgs+
487	CaS	Calcium sulfide	cas
488	ZnO	zinc monoxide	zno
489	ZnS	Zinc sulfide	zns
490	BeS^-	Beryllium monosulfide anion	bes-
491	BeS⁺	Beryllium monosulfide cation	bes+
492	BO	boron monoxide	bo
493	BO^-	boron monoxide anion	bo-
494	AlO	Aluminum monoxide	alo
495	AlO^-	Aluminum monoxide anion	alo-
496	AlO⁺	aluminum monoxide cation	alo+
497	BS	boron sulfide	bs
498	BS^-	boron monosulfide anion	bs-
499	BS⁺	boron monosulfide cation	bs+
500	AlS	Aluminum sulfide	als
501	AlS^-	aluminum monosulfide anion	als-
502	AlS⁺	aluminum monosulfide cation	als+
503	ScO	Scandium monoxide	sco
504	GaO	Gallium monoxide	gao
505	GaS	Gallium monosulfide	gas
506	BO⁺	boron monoxide cation	bo+
507	CO	Carbon monoxide	co
508	CO^-	carbon monoxide anion	co-
509	CO⁺	carbon monoxide cation	co+
510	CS	carbon monosulfide	cs
511	CS^-	carbon monosulfide anion	cs-
512	CS⁺	carbon monosulfide cation	cs+
513	SiO^-	silicon monoxide anion	sio-
514	SiO⁺	silicon monoxide cation	sio+
515	SiS	silicon monosulfide	sis
516	SiS^-	silicon monosulfide anion	sis-
517	SiS⁺	silicon monosulfide cation	sis+
518	TiO	Titanium monoxide	tio
519	CSe	Carbon monoselenide	cse
520	CSe^-	Carbon monoselenide anion	cse-
521	CSe⁺	Carbon monoselenide cation	cse+
522	GeO	Germanium monoxide	geo
523	GeO⁺	Germanium monoxide cation	geo+
524	GeS	Germanium monosulfide	ges
525	SiSe	Silicon Monoselenide	sise
526	SiSe⁺	Silicon Monoselenide cation	sise+
527	GeSe	Germanium monoselenide	gese
528	NO	Nitric oxide	no
529	NO^-	nitric oxide anion	no-
530	NO⁺	nitric oxide cation	no+
531	NS^-	nitrogen sulfide anion	ns-
532	NS⁺	nitrogen sulfide cation	ns+
533	PO^-	phosphorus monoxide anion	po-
534	PO⁺	phosphorus monoxide cation	po+
535	PS	phosphorus sulfide	ps
536	PS^-	phosphorus monosulfide anion	ps-
537	PS⁺	phosphorus monosulfide cation	ps+
538	VO	Vanadium monoxide	vo
539	AsO	Arsenic monoxide	aso
540	NSe	Nitrogen monoselenide	nse
541	AsS	Arsenic monosulfide	ass
542	PSe	Phosphorus monoselenide	pse
543	AsSe	Arsenic monoselenide	asse
544	O₂^-	oxygen diatomic anion	o2-
545	O₂⁺	diatomic oxygen cation	o2+
546	SO^-	sulfur monoxide anion	so-
547	SO⁺	sulfur monoxide cation	so+
548	S₂	Sulfur diatomic	s2
549	S₂^-	sulfur diatomic anion	s2-
550	S₂⁺	sulfur diatomic cation	s2+
551	SeO	Selenium monoxide	seo
552	SeO^-	selenium monoxide anion	seo-
553	SeO⁺	selenium monoxide cation	seo+
554	SeS	Selenium monosulfide	ses
555	SeS^-	selenium monosulfide anion	ses-
556	SeS⁺	selenium monosulfide cation	ses+
557	TeO	Tellurium monoxide	teo
558	Se₂	Selenium diatomic	se2
559	Se₂^-	selenium diatomic anion	se2-
560	Se₂⁺	selenium diatomic cation	se2+
561	Te₂	Tellurium diatomic	te2
562	LiOH	lithium hydroxide	lioh
563	NaOH	sodium hydroxide	naoh
564	KOH	Potassium hydroxide	koh
565	BeOH	beryllium monohydroxide	beoh
566	MgOH	magnesium hydroxide	mgoh
567	CaOH	Calcium monohydroxide	caoh
568	HBO	Boron hydride oxide	hbo
569	COH	Hydroxymethylidyne	coh
570	COH⁺	Carbon Monoxide, protonated	coh+
571	HCO	Formyl radical	hco
572	HCO^-	formyl anion	hco-
573	HCO⁺	Formyl cation	hco+
574	HCS	Thioformyl radical	hcs
575	HCS^-	Thioformyl anion	hcs-
576	HCS⁺	Thioformyl cation	hcs+
577	HNO^-	Nitrosyl hydride anion	hno-
578	HNO⁺	Nitrosyl hydride cation	hno+
579	NOH	Hydroxyimidogen	noh
580	NOH⁺	O-protonated nitric oxide	noh+
581	HNS	Sulfur imide	hns
582	HNS^-	Sulfur imide anion	hns-
583	HO₂^-	Hydroperoxy anion	ho2-
584	HO₂⁺	Hydroperoxy cation	ho2+
585	HSO⁺	Sulfur Monoxide, S-protonated	HSO+
586	SOH	Sulfur Hydroxide	soh
587	SOH⁺	Sulfur Monoxide, protonated	soh+
588	HS₂	Thiosulfeno radical	hs2
589	H₂CO^-	formaldehyde anion	h2co-
590	H₂CO⁺	formaldehyde cation	h2co+
591	HOCH	hydroxycarbene	hoch
592	H₂CS	Thioformaldehyde	h2cs
593	H₂CS^-	thioformaldehyde anion	h2cs-
594	H₂CS⁺	thioformaldehyde cation	h2cs+
595	H₂CSe	Selenoformaldehyde	h2cse
596	H₂NO	nitroxide	h2no
597	H₂O₂	Hydrogen peroxide	h2o2
598	H₂O₂⁺	Hydrogen peroxide cation	h2o2+
599	H₂OO	water oxide	h2oo
600	HOSH	hydrogen thioperoxide	hosh
601	H₂S₂⁺	hydrogen disulfide cation	h2s2+
602	H₂Se₂	hydrogen diselenide	h2se2
603	CH₂OH	Hydroxymethyl radical	ch2oh
604	CH₂OH⁺	hydroxymethyl cation	ch2oh+
605	CH₃O	Methoxy radical	ch3o
606	CH₃O^-	methoxy anion	ch3o-
607	CH₃O⁺	Methoxy cation	ch3o+
608	CH₃S	thiomethoxy	ch3s
609	H₂CSH⁺	Thioformaldehyde, protonated	h2csh+
610	NH₂OH	hydroxylamine	nh2oh
611	NH₂OH⁺	Hydroxylamine cation	nh2oh+
612	NH₃O	Ammonia Oxide	nh3o
613	H₂POH	Phosphinous acid	h2poh
614	H₃PO	Phosphine oxide	h3po
615	NH₂SH	Thiohydroxylamine	nh2sh
616	NH₃S	sulfidoazane	nh3s
617	H₃O₂⁺	hydrogen peroxide, protonated	h3o2+
618	CH₃OH	Methyl alcohol	ch3oh
619	CH₃OH^-	Methyl alcohol anion	ch3oh-
620	CH₃OH⁺	Methyl alcohol cation	ch3oh+
621	CH₃SH	Methanethiol	ch3sh
622	CH₃SH⁺	Methanethiol cation	ch3sh+
623	SiH₃OH	silanol	sih3oh
624	CH₃SeH	Methane selenol	ch3seh
625	NH₂OH₂⁺	protonated hydroxylamine	nh2oh2+
626	NH₃OH⁺	N-protonated hydroxylamine	nh3oh+
627	H₂OH₂O	water dimer	h2oh2o
628	CH₃OH₂⁺	Methanol, protonated	ch3oh2+
629	CH₃SH₂⁺	protonated methylsulfide	ch3sh2+
630	H₂ONH₃	Water Ammonia Dimer	h2onh3
631	H₅O₂⁺	Dihydroxonium ion	h5o2+
632	LiF	lithium fluoride	lif
633	LiCl	lithium chloride	licl
634	LiCl^-	lithium chloride anion	licl-
635	LiCl⁺	lithium chloride cation	licl+
636	NaF	sodium fluoride	naf
637	NaF^-	sodium fluoride anion	naf-
638	NaF⁺	sodium fluoride cation	naf+
639	KF	Potassium Fluoride	kf
640	NaCl	Sodium Chloride	nacl
641	NaCl^-	sodium chloride anion	nacl-
642	NaCl⁺	sodium chloride cation	nacl+
643	KCl	Potassium Chloride	kcl
644	CuF	Copper monofluoride	cuf
645	LiBr	Lithium Bromide	libr
646	LiBr^-	lithium bromide anion	libr-
647	LiBr⁺	lithium bromide cation	libr+
648	CuCl	Copper monochloride	cucl
649	NaBr	Sodium Bromide	nabr
650	NaBr^-	sodium bromide anion	nabr-
651	NaBr⁺	sodium bromide cation	nabr+
652	KBr	Potassium Bromide	kbr
653	LiI	Lithium Iodide	lii
654	NaI	Sodium Iodide	nai
655	KI	Potassium Iodide	ki
656	LiF^-	lithium fluoride anion	lif-
657	LiF⁺	lithium fluoride cation	lif+
658	BeF	Beryllium monofluoride	bef
659	BeF^-	Beryllium monofluoride anion	bef-
660	BeF⁺	Beryllium monofluoride cation	bef+
661	BeCl	beryllium monochloride	becl
662	MgF	Magnesium monofluoride	mgf
663	MgF^-	magnesium fluoride anion	mgf-
664	MgF⁺	magnesium fluoride cation	mgf+
665	CaF	Calcium monofluoride	caf
666	MgCl	magnesium monochloride	mgcl
667	MgCl^-	magnesium monochloride anion	mgcl-
668	MgCl⁺	magnesium monochloride cation	mgcl+
669	CaCl	calcium monochloride	cacl
670	TiCl	Titanium Monochloride	ticl
671	ZnF	Zinc monofluoride	znf
672	ZnF^-	Zinc monofluoride anion	znf-
673	ZnF⁺	Zinc monofluoride cation	znf+
674	ZnCl	Zinc monochloride	zncl
675	CaBr	Calcium monobromide	cabr
676	BeCl^-	beryllium monochloride anion	becl-
677	BeCl⁺	beryllium monochloride cation	becl+
678	BF^-	Boron monofluoride anion	bf-
679	BF⁺	Boron monofluoride cation	bf+
680	AlF	Aluminum monofluoride	alf
681	AlF^-	Aluminum monofluoride anion	alf-
682	AlF⁺	Aluminum monofluoride cation	alf+
683	BCl	boron monochloride	bcl
684	BCl^-	boron monochloride anion	bcl-
685	BCl⁺	boron monochloride cation	bcl+
686	AlCl	Aluminum monochloride	alcl
687	AlCl^-	aluminum monochloride anion	alcl-
688	AlCl⁺	aluminum monochloride cation	alcl+
689	ScF	Scandium monofluoride	scf
690	BBr	Boron monobromide	bbr
691	GaF	Gallium monofluoride	gaf
692	GaF⁺	Gallium monofluoride cation	gaf+
693	AlBr	Aluminum monobromide	albr
694	GaCl	Gallium monochloride	gacl
695	GaCl⁺	Gallium monochloride cation	gacl+
696	AlI	Aluminum monoiodide	ali
697	GaBr	Gallium monobromide	gabr
698	CF^-	carbon monofluoride anion	cf-
699	CF⁺	carbon monofluoride cation	cf+
700	CCl	carbon monochloride	ccl
701	CCl^-	carbon monochloride anion	ccl-
702	CCl⁺	carbon monochloride cation	ccl+
703	SiF^-	silicon monofluoride anion	sif-
704	SiCl	Clorosilylidyne	sicl
705	SiCl^-	silicon monochloride anion	sicl-
706	SiCl⁺	silicon monochloride cation	sicl+
707	CBr	Carbon monobromide	cbr
708	GeF	Germanium monofluoride	gef
709	GeF⁺	Germanium monofluoride cation	gef+
710	GeCl	Germanium monochloride	gecl
711	GeCl⁺	Germanium monochloride cation	gecl+
712	SiBr	Silicon monobromide	sibr
713	SiBr⁺	Silicon monobromide cation	sibr+
714	NF	nitrogen fluoride	nf
715	NF^-	nitrogen monofluorine anion	nf-
716	NF⁺	nitrogen monofluoirde cation	nf+
717	NCl	nitrogen monochloride	ncl
718	NCl^-	nitrogen monochloride anion	ncl-
719	NCl⁺	nitrogen monochloride cation	ncl+
720	PF	phosphorus monofluoride	pf
721	PF^-	phosphorus monofluoride anion	pf-
722	PF⁺	phosphorus monofluoride cation	pf+
723	PCl	phosphorus chloride	pcl
724	PCl^-	phosphorus monochloride anion	pcl-
725	PCl⁺	phosphorus monochloride cation	pcl+
726	AsF	Arsenic monofluoride	asf
727	NBr	nitrogen monobromide	nbr
728	AsCl	Arsenic monochloride	ascl
729	PBr	Phosphorus monobromide	pbr
730	SbF	Antimony monofluoride	sbf
731	SbCl	Antimony monochloride	sbcl
732	FO	Oxygen monofluoride	fo
733	FO^-	flourine oxide anion	fo-
734	FO⁺	fluorine monoxide cation	fo+
735	ClO^-	chlorine monoxide anion	clo-
736	ClO⁺	chlorine monoxide cation	clo+
737	SF^-	sulfur monofluoride anion	sf-
738	SCl	sulfur monochloride	scl
739	SCl^-	sulfur monochloride anion	scl-
740	BrO	Bromine monoxide	bro
741	BrO^-	Bromine monoxide anion	bro-
742	BrO⁺	Bromine monoxide cation	bro+
743	SeF	Selenium monofluoride	sef
744	SBr	Sulfur monobromide radical	sbr
745	SBr⁺	Sulfur monobromide cation	sbr+
746	SeCl	Selenium monochloride	secl
747	IO	Iodine monoxide	io
748	SeBr	Selenium monobromide	sebr
749	BrCl	Bromine monochloride	brcl
750	F₂	Fluorine diatomic	f2
751	F₂^-	flourine diatomic anion	f2-
752	F₂⁺	flourine diatomic cation	f2+
753	ClF	Chlorine monofluoride	clf
754	ClF^-	clorine monofluoride anion	clf-
755	ClF⁺	clorine monofluoride cation	clf+
756	Cl₂^-	chlorine diatomic anion	cl2-
757	Cl₂⁺	chlorine diatomic cation	cl2+
758	BrF	Bromine monofluoride	brf
759	BrF^-	bromine fluoride anion	brf-
760	BrF⁺	bromine fluoride cation	brf+
761	BrCl^-	bromine chloride anion	brcl-
762	BrCl⁺	bromine chloride cation	brcl+
763	IF	Iodine monofluoride	if
764	Br₂	Bromine diatomic	br2
765	Br₂^-	bromine diatomic anion	br2-
766	Br₂⁺	bromine diatomic cation	br2+
767	ICl	Iodine monochloride	icl
768	IBr	Iodine monobromide	ibr
769	I₂	Iodine diatomic	i2
770	I₂⁺	Iodine diatomic cation	i2+
771	HCF	Fluoromethylene	hcf
772	HCCl	Chloromethylene	hccl
773	HSiF	fluorosilylene	hsif
774	HSiCl	Chlorosilylene	hsicl
775	HSiBr	monobromosilylene	hsibr
776	CHBr	bromomethylene	chbr
777	DOCl	Hypochlorous acid-d	docl
778	HOCl⁺	hypochlorous acid cation	hocl+
779	HOBr	Hypobromous acid	hobr
780	HOBr⁺	Hypobromous acid cation	hobr+
781	HOI	Hypoiodous acid	hoi
782	F₂H⁺	Fluorine, protonated	f2h+
783	FHF	Hydrogen difluoride	fhf
784	FHF^-	Hydrogen difluoride anion	fhf-
785	ClFH⁺	Chlorine fluoride, F-protonated	clfh+
786	FClH⁺	Chlorine fluoride, Cl-protonated	fclh+
787	Cl₂H⁺	Chlorine, protonated	cl2h+
788	CH₂Br	bromomethyl radical	ch2br
789	CH₂F	fluoromethyl radical	ch2f
790	CH₂F⁺	fluoromethyl cation	ch2f+
791	CH₂Cl⁺	chloromethyl cation	ch2cl+
792	CH₂Cl	chloromethyl radical	ch2cl
793	NH₂F	monofluoroamine	nh2f
794	NH₂Cl	chloramine	nh2cl
795	H₂F₂	Hydrogen fluoride dimer	h2f2
796	CH₃F⁺	methyl fluoride cation	ch3f+
797	CD₃F	methylfluoride-d3	cd3f
798	CH₃F	Methyl fluoride	ch3f
799	CD₃Cl	methyl chloride d3	cd3cl
800	CH₃Cl⁺	Methyl chloride cation	ch3cl+
801	SiH₃Cl	chlorosilane	sih3cl
802	CH₃Br	methyl bromide	ch3br
803	GeH₃F	monofluorogermane	geh3f
804	GeH₃Cl	monochlorogermane	geh3cl
805	SiH₃Br	bromosilane	sih3br
806	CH₃I	methyl iodide	ch3i
807	SiH₃I	Silyl Iodide	sih3i
808	NH₃Cl⁺	protonated monochloroammonia	nh3cl+
809	CH₃ClH⁺	methyl chloride, protonated	ch3clh+
810	NH₄Cl	Ammonium chloride	nh4cl
811	LiNe⁺	Lithium Neon cation	line+
812	Ne₂	Neon diatomic	ne2
813	Ne₂⁺	Neon diatomic cation	ne2+
814	Ar₂	Argon diatomic	ar2
815	Ar₂⁺	Argon diatomic cation	ar2+
816	Li₃	Lithium trimer	li3
817	Li₃⁺	Lithium trimer cation	li3+
818	C₃	carbon trimer	c3
819	C₃⁺	carbon trimer cation	c3+
820	C₃H₃	cyclopropenyl radical	cpr
821	C₃H₃	Propargyl radical	propargyl
822	C₃H₃^-	Propargyl anion	c3h3-
823	C₃H₃⁺	cyclopropenyl cation	cpr+
824	C₃H₃⁺	Propargyl cation	c3h3+
825	C₃H₄	cyclopropene	cprop
826	CH₂CCH₂	allene	allene
827	CH₃CCH	propyne	propyne
828	C₃H₅	Allyl radical	allyl
829	C₃H₅⁺	Allyl cation	allyl+
830	CH₃CHCH	1-propenyl radical	ch3chch
831	Zn(CH₃)₂	dimethyl zinc	dmz
832	C₃H₆	Cyclopropane	c3h6
833	CH₂CHCH₃	Propene	propene
834	C₃H₇	n-Propyl radical	npropyl
835	C₃H₇⁺	cyclopropane, protonated	c3h7+
836	CH₃CHCH₃	Isopropyl radical	isopropyl
837	CH₃CHCH₃⁺	Isopropyl cation	prop2yl+
838	C₃H₈	Propane	propane
839	SiH₂(CH₃)₂	dimethylsilane	dms
840	LiCN	lithium cyanide	licn
841	KCN	Potassium cyanide	kcn
842	CuCN	Copper cyanide	cucn
843	ZnCN	Zinc monocyanide	zncn
844	ZnNC	Zinc isocyanide	znnc
845	AlCN	Aluminum monocyanide	alcn
846	CN₂	3H-Diazirin-3-ylidene	cn2
847	CNN	Diazocarbene	cnn
848	NCN	Cyanoimidogen	ncn
849	N₃	azide radical	n3
850	N₃^-	azide anion	n3-
851	N₃⁺	azide cation	n3+
852	HCCN	cyanomethylene	hccn
853	HCNN	diazomethyl radical	hcnn
854	HN₃	hydrogen azide	hn3
855	HN₃⁺	Hydrazoic acid cation	hn3+
856	HNCNH	diiminomethane	hncnh
857	CH₂N₂	diazirine	ch2n2
858	CH₂NN	diazomethane	ch2nn
859	NH₂CN	cyanamide	cyanamide
860	HNNNH⁺	1,2-Triazadienium	n2h3+
861	NH₂NN⁺	hydrazoic acid, protonated	nh2nn+
862	CH₃CN	Acetonitrile	ch3cn
863	CH₃CN^-	acetonitrile anion	ch3cn-
864	CH₃CN⁺	Acetonitrile cation	ch3cn+
865	CH₃NC	methyl isocyanide	ch3nc
866	CHNCH₂	2H-Azirine	c157164
867	CHNHCH	1H-Azirine	chnhch
868	H₂CCNH	Ethenimine	ch2cnh
869	H₂CNCH	methyleneaminomethylene	ch2nch
870	HCCNH₂	Ethynamine	hccnh2
871	HCNCH₂⁺	2H-Azirine cation	hcnch2+
872	HNCNH₂⁺	diiminomethane, protonated	hncnh2+
873	NCNH₃⁺	Cyanamide, protonated	ncnh3+
874	NH₂CNH⁺	cyanamide, cn protonated	nh2cnh+
875	NH₃CN⁺	cyanamide, amine protonated	nh3cn+
876	CH₂CHNH	vinylazine	ch2chnh
877	CH₃CHN	methylmethaniminyl radical	ch3chn
878	NHCHNH₂	aminomethanimine	cn2h4
879	C₂H₅N	Aziridine	c2h5n
880	CH₂CHNH₂	aminoethene	aminoethene
881	CH₂NCH₃	N-methylmethanimine	nmm
882	CH₃CHNH	ethanimine	ethanimine
883	NH₂BHNH₂	diaminoborane	nh2bhnh2
884	C₂H₅NH⁺	Protonated Aziridine	c2h5nh+
885	C₂H₆N⁺	aziridine, protonated	c2h6n+
886	NH₂CH₂NH₂	diaminomethane	nh2ch2nh2
887	CH₃CH₂NH₂	Ethylamine	etam
888	CH₃NHCH₃	Dimethylamine	ch3nhch3
889	CH₃PHCH₃	dimethylphosphine	ch3phch3
890	NH₂CH₂NH₃⁺	diaminoethane, protonated	pdam
891	(CH₃)₂NH₂⁺	dimethylammonium cation	dmam
892	CH₃CH₂NH₃⁺	ethylamine, protonated	pea
893	Li₂O	dilithium oxide	li2o
894	Li₂O⁺	dilithium oxide cation	li2o+
895	Li₂S	dilithium sulfide	li2s
896	Na₂O	disodium monoxide	na2o
897	LiO₂	Lithium dioxide	lio2
898	NaO₂	Sodium superoxide	nao2
899	CCO	Dicarbon monoxide	cco
900	CNO^-	fulminate	cno-
901	NCO	isocyanato radical	nco
902	NCO^-	cyanate	nco-
903	SCN	thiocyanato radical	scn
904	SCN^-	thiocyanide anion	scn-
905	BO₂	Boron dioxide	bo2
906	BO₂^-	Boron dioxide anion	bo2-
907	BO₂⁺	Boron dioxide cation	bo2+
908	N₂O^-	Nitrous oxide anion	n2o-
909	N₂O⁺	Nitrous oxide cation	n2o+
910	NNS	Nitrogen sulfide	nns
911	PPO	Phosphorus oxide phosphide	ppo
912	CO₂	Carbon dioxide	co2
913	CO₂^-	Carbon dioxide anion	co2-
914	CO₂⁺	Carbon dioxide cation	co2+
915	OCS	Carbonyl sulfide	cos
916	OCS⁺	Carbonyl sulfide cation	cos+
917	SiO₂	silicon dioxide	sio2
918	CS₂	Carbon disulfide	cs2
919	CS₂^-	Carbon disulfide anion	cs2-
920	CS₂⁺	Carbon disulfide cation	cs2+
921	TiO₂	Titanium dioxide	tio2
922	GeO₂	Germanium dioxide	geo2
923	OCSe	Carbonyl selenide	ocse
924	SCSe	Carbon sulfide selenide	scse
925	GeS₂	Germanium disulfide	ges2
926	CSe₂	Carbon diselenide	cse2
927	SCTe	Carbon sulfide Telluride	scte
928	NO₂	Nitrogen dioxide	no2
929	NO₂^-	Nitrogen dioxide anion	no2-
930	NO₂⁺	Nitrogen dioxide cation	no2+
931	NSO	sulfinyl amidogen	NSO
932	PO₂	Phosphorus dioxide	po2
933	PO₂^-	Phosphorus dioxide anion	po2-
934	PO₂⁺	Phosphorus dioxide cation	po2+
935	SNO	Nitrogen oxide sulfide	sno
936	AsO₂	Aresenic dioxide	aso2
937	O₃	Ozone	o3
938	O₃^-	Ozone anion	o3-
939	O₃⁺	Ozone cation	o3+
940	SO₂^-	Sulfur dioxide anion	so2-
941	SO₂⁺	Sulfur dioxide cation	so2+
942	SSO	Disulfur monoxide	sso
943	S₃	Sulfur trimer	s3
944	S₃^-	Sulfur trimer anion	s3-
945	S₃⁺	Sulfur trimer cation	s3+
946	SeO₂	Selenium dioxide	seo2
947	SeO₂⁺	Selenium dioxide cation	seo2+
948	TeO₂	Tellurium Dioxide	teo2
949	HCCO	ketenyl radical	ketenyl
950	CS₂H⁺	Carbon disulfide, protonated	cs2h+
951	HNCO	Isocyanic acid	hnco
952	HOCN	cyanic acid	hocn
953	HNCS	Isothiocyanic acid	hncs
954	HSCN	thiocyanic acid	hscn
955	HCO₂^-	formate anion	hco2-
956	HNNO	nitrosoazane	hnno
957	HNNO⁺	Nitrous oxide, N-protonated	hnno+
958	NNOH⁺	Nitrous Oxide, O-protonated	nnoh+
959	HCOO	formate neutral radical	hcoo
960	HOCO	Hydrocarboxyl radical	hoco
961	HOCO⁺	Hydrocarboxyl cation	hoco+
962	HNO₂	Nitrous acid	hno2
963	HNO₂⁺	nitrous acid cation	hno2+
964	O₃H⁺	protonated ozone	o3h+
965	SO₂H⁺	protonated sulfur dioxide	so2h+
966	C₂H₂O	Oxirene	oxirene
967	CH₂CO	Ketene	ch2co
968	CH₂CO⁺	Ketene cation	ch2co+
969	HCCOH	ethynol	hccoh
970	CH₂CS	Thioketene	ch2cs
971	Be(OH)₂	Beryllium hydroxide	beo2h2
972	Mg(OH)₂	Magnesium dihydroxide	h2mgo2
973	NH₂NO	Nitrosamide	nh2no
974	CH₂O₂	Dioxirane	diox
975	H₂COO	Dioxymethyl radical	h2coo
976	H₂COO⁺	dioxymethyl cation	h2coo+
977	HCOOH	Formic acid	ch2o2
978	H₂O₃	Hydrogen trioxide	h2o3
979	HSSSH	trisulfane	hsssh
980	NaOCH₃	Sodium methoxide	naoch3
981	CH₂BOH	hydroxy(methylene)borane	ch2boh
982	BH₃CO	Borane carbonyl	bh3co
983	CH₃BO	Borane, methyloxo-	ch3bo
984	CH₂CHO	Vinyloxy radical	ch2cho
985	CH₂COH⁺	ketene, protonated	ch2coh+
986	CH₃CO	Acetyl radical	ch3co
987	CH₃CO^-	Acetyl anion	ch3co-
988	CH₃CO⁺	acetyl cation	ch3co+
989	CH₂NOH	formaldoxime	ch2noh
990	CH₃NO	nitrosomethane	ch3no
991	CHONH₂	formamide	formamide
992	CNOH₃	1,2-oxaziridine	cnoh3
993	HOCHNH	hydroxymethylimine	hochnh
994	CHSNH₂	thioformamide	chsnh2
995	NHCHSH	Methanimidothioic acid	nhchsh
996	CH₂OOH	CH2OOH radical	ch2ooh
997	CH₃OO	methylperoxy radical	ch3oo
998	CH₃OO^-	methylperoxy anion	ch3oo-
999	CH₃OO⁺	methylperoxy cation	ch3oo+
1000	C₂H₄O	Ethylene oxide	c2h4o
1001	C₂H₄O⁺	ethylene oxide cation	c2h4o+
1002	CH₂CHOH	ethenol	ch2choh
1003	CH₃CHO	Acetaldehyde	ch3cho
1004	CH₃CHO⁺	acetaldehyde cation	ch3cho+
1005	H₂COCH₂⁺	Methyl, (methyleneoxoniumyl)-	h2coch2+
1006	C₂H₄S	Thiirane	thiirane
1007	CH₂CHSH	Ethenethiol	ch2chsh
1008	CH₃CHS	Thioacetaldehyde	ch3chs
1009	H₂CONH₂⁺	protonated formamide	h2conh2+
1010	NH₂CHOH⁺	Formamide, O-protonated	nh2choh+
1011	NH₃CHO⁺	Formamide, N-Protonated	nh3cho+
1012	CH₂(OH)₂	methanediol	ch2o2h2
1013	CH₃OOH	Methyl peroxide	ch3ooh
1014	CH₃SSH	Hydrogen methyl disulfide	ch3ssh
1015	HSCH₂SH	Methanedithiol	ch4s2
1016	H₂OH₂CO	water formaldehyde dimer	h2oh2co
1017	C₂H₄OH⁺	ethylene oxide, protonated	c2h4oh+
1018	CH₂CH₂OH	2-hydroxy ethyl radical	ch2ch2oh
1019	CH₃CH₂O	Ethoxy radical	ethoxy
1020	CH₃CHOH	1-hydroxy-ethyl radical	ch3choh
1021	CH₃CHOH⁺	acetaldehyde, protonated	ch3choh+
1022	CH₃OCH₂	methoxymethyl radical	ch3och2
1023	NH₂CH₂OH	aminomethanol	nh2ch2oh
1024	CH₃CH₂OH	Ethanol	etoh
1025	CH₃OCH₃	Dimethyl ether	meome
1026	CH₃CH₂SH	ethanethiol	etsh
1027	CH₃SCH₃	Dimethyl sulfide	mesme
1028	CH₃SCH₃⁺	dimethyl sulfide cation	mesme+
1029	CH₃SeCH₃	dimethylselenide	dmse
1030	CH₃OHH₂O	methanol water dimer	ch3ohh2o
1031	H₂OCH₃OH	water methanol dimer	h2och3oh
1032	CuF₂	Copper difluoride	cuf2
1033	ZnF₂	Zinc difluoride	znf2
1034	CNF	iso cyanogen fluoride	cnf
1035	FCN	Cyanogen fluoride	fcn
1036	ClCN	chlorocyanogen	clcn
1037	BrCN	Cyanogen bromide	brcn
1038	ICN	Cyanogen iodide	icn
1039	FBO	Boron monofluoride monoxide	fbo
1040	BeF₂	Beryllium fluoride	bef2
1041	MgF₂	Magnesium fluoride	mgf2
1042	BeCl₂	Beryllium chloride	becl2
1043	MgCl₂	Magnesium dichloride	mgcl2
1044	CaCl₂	Calcium Chloride	cacl2
1045	ZnCl₂	Zinc dichloride	zncl2
1046	BeBr₂	Beryllium bromide	bebr2
1047	CaBr₂	Calcium dibromide	cabr2
1048	CaF₂	Calcium difluoride	caf2
1049	FCO	Carbonyl fluoride	fco
1050	FCO⁺	Carbonyl fluoride cation	fco+
1051	ClCO	carbonyl monochloride	clco
1052	BF₂	Boron difluoride radical	bf2
1053	FNO	Nitrosyl fluoride	fno
1054	FNS	Thionitrosyl fluoride	fns
1055	FSN	Thiazyl fluoride	fsn
1056	BrNO	Nitrosyl bromide	brno
1057	INO	Nitrosyl iodide	ino
1058	CF₂^-	Difluoromethylene anion	cf2-
1059	CF₂⁺	Difluoromethylene cation	cf2+
1060	CFCl	chlorofluoromethylene	cfcl
1061	SiF₂⁺	Silicon difluoride cation	sif2+
1062	CCl₂	dichloromethylene	ccl2
1063	CCl₂^-	dichloromethylene anion	ccl2-
1064	CCl₂⁺	dichloromethylene cation	ccl2+
1065	SiCl₂	Dichlorosilylene	sicl2
1066	GeF₂	Germanium difluoride	gef2
1067	GeCl₂	Germanium dichloride	gecl2
1068	CBr₂	dibromomethylene	cbr2
1069	FOO	Dioxygen monofluoride radical	foo
1070	FOO⁺	Fluorine dioxide cation	foo+
1071	ClOO	chloroperoxy radical	cloo
1072	ClOO⁺	chloroperoxy cation	cloo+
1073	OClO	Chlorine dioxide	oclo
1074	OClO^-	Chlorine dioxide anion	oclo-
1075	OClO⁺	Chlorine dioxide cation	oclo+
1076	ClSO	Sulfur chloride oxide	clso
1077	ClS₂	Sulfur chloride	cls2
1078	BrOO	Bromine dioxide	broo
1079	OBrO	Bromine dioxide radical	obro
1080	NF₂	Difluoroamino radical	nf2
1081	NF₂⁺	Difluoroamino cation	nf2+
1082	PF₂	Phosphorus difluoride	pf2
1083	PF₂⁺	Phosphorus difluoride cation	pf2+
1084	F₂O	Difluorine monoxide	f2o
1085	SF₂^-	sulfur difluoride anion	sf2-
1086	SF₂⁺	sulfur difluoride cation	sf2+
1087	Cl₂O	Dichlorine monoxide	cl2o
1088	SCl₂	Sulfur dichloride	scl2
1089	SeF₂	Selenium difluoride	sef2
1090	BrOCl	Bromine hypochlorite	brocl
1091	SeCl₂	Selenium Dichloride	secl2
1092	SBr₂	Sulfur dibromide	sbr2
1093	SeBr₂	Selenium dibromide	sebr2
1094	BrOBr	Bromine oxide	brobr
1095	F₃^-	trifluoride anion	f3-
1096	Cl₃^-	trichloride anion	cl3-
1097	Br₃^-	tribromide anion	br3-
1098	I₃^-	triiodide	i3-
1099	SFCl	Sulfur chloride fluoride	sfcl
1100	HCCF⁺	fluoroacetylene cation	hccf+
1101	HCCCl	Chloroacetylene	hcccl
1102	HCCBr	bromoacetylene	hccbr
1103	HFCO	formyl fluoride	hfco
1104	HFCO⁺	formyl fluoride cation	hfco+
1105	COHCl	Formyl chloride	cohcl
1106	COHBr	Formyl bromide	cohbr
1107	BHF₂	Difluoroborane	bhf2
1108	BHCl₂	Borane, dichloro-	bhcl2
1109	CHCl₂	dichloromethyl radical	chcl2
1110	CHF₂	difluoromethyl radical	chf2
1111	CHF₂⁺	difluoromethyl cation	chf2+
1112	CHFCl	Chlorofluoromethyl radical	chfcl
1113	CHFCl⁺	Chlorofluoromethyl cation	chfcl+
1114	CHCl₂⁺	dichloromethyl cation	chcl2+
1115	CHBr₂	dibromomethyl radical	chbr2
1116	HOClO	Chlorous acid	hoclo
1117	NHF₂	difluoramine	nhf2
1118	NHCl₂	dichloroamine	nhcl2
1119	CH₂FCl	fluorochloromethane	ch2fcl
1120	CH₂Cl₂	Methylene chloride	ch2cl2
1121	CH₂BrF	Methane, bromofluoro-	ch2fbr
1122	CH₂BrCl	Methane, bromochloro-	ch2clbr
1123	CH₂FI	fluoroiodomethane	ch2fi
1124	CH₂Br₂	dibromomethane	ch2br2
1125	CH₂ClI	chloroiodomethane	ch2cli
1126	CH₂BrI	bromoiodomethane	ch2bri
1127	CH₂I₂	Diiodomethane	ch2i2
1128	CH₃MgBr	Methyl Magnesium Bromide	ch3mgbr
1129	CH₂CHF	Ethene, fluoro-	ch2chf
1130	CH₂CHF⁺	fluoroethene cation	ch2chf+
1131	C₂H₃Cl	Ethene, chloro-	ch2chcl
1132	C₂H₃Br	vinyl bromide	c2h3br
1133	C₂H₃I	Vinyl iodide	c2h3i
1134	CH₂FOH	fluoromethanol	ch2foh
1135	CH₃OCl	methyl hypochlorite	ch3ocl
1136	CH₂CH₂Cl	2-chloroethyl radical	ch2ch2cl
1137	CHClCH₃	1-chloroethyl radical	chclch3
1138	C₂H₅F	fluoroethane	c2h5f
1139	CH₃CH₂Cl	Ethyl chloride	c2h5cl
1140	CH₃SiFH₂	fluoromethylsilane	ch3sifh2
1141	C₂H₅Br	Ethyl bromide	etbr
1142	C₂H₅I	Ethyl iodide	c2h5i
1143	KrF₂	Krypton difluoride	krf2
1144	XeF₂	Xenon difluoride	xef2
1145	B₄H₁₀	Tetraborane(10)	b4h10
1146	C₄	Carbon tetramer	c4
1147	C₄⁺	Carbon tetramer cation	c4+
1148	C₄H₂	Diacetylene	c4h2
1149	C₄H₂⁺	diacetlyene cation	c4h2+
1150	C₂H₃CCH	1-Buten-3-yne	c2h3cch
1151	C₄H₄	cyclobutadiene	cbd
1152	C₄H₄	Tetrahedrane	c4h4
1153	H₂CCCCH₂	Butatriene	h2cccch2
1154	C₄H₆	1-Methylcyclopropene	c3100047
1155	C₄H₆	Cyclobutene	c822355
1156	C₄H₆	Methylenecyclopropane	c6142730
1157	CH₂CCHCH₃	1,2-Butadiene	butad12
1158	CH₂CHCHCH₂	1,3-Butadiene	c106990
1159	CH₃CCCH₃	2-Butyne	c503173
1160	CHCCH₂CH₃	1-Butyne	c107006
1161	CH₃CHCHCH₂	methylallyl radical	c4h7
1162	C₄H₈	methylcyclopropane	mcp
1163	CH₂C(CH₃)CH₃	1-Propene, 2-methyl-	isobute
1164	CH₂CHCH₂CH₃	1-Butene	bute1
1165	CH₃CHCHCH₃	2-Butene, (E)-	bute2e
1166	CH₃CHCHCH₃	2-Butene, (Z)-	bute2z
1167	B(CH₃)₃	trimethylborane	bme3
1168	Al(CH₃)₃	trimethyl aluminum	tma
1169	C(CH₃)₃	Tert-butyl radical	tbutyl
1170	CH₂CH(CH₃)₂	Isobutyl radical	isobutyl
1171	CH₃CHCH₂CH₃	2-Butyl radical	butyl2
1172	CH₃CH(CH₃)CH₃	Isobutane	isobutane
1173	CH₃CH₂CH₂CH₃	Butane	butane
1174	SiH(CH₃)₃	trimethylsilane	trimsi
1175	Li₃N	trilithium nitride	li3n
1176	C₂N₂	Cyanogen	c2n2
1177	C₂N₂⁺	Cyanogen cation	c2n2+
1178	P₄	Phosphorus tetramer	p4
1179	As₄	Arsenic tetramer	as4
1180	HCCCN	Cyanoacetylene	hcccn
1181	HCCCN⁺	Cyanoacetylene cation	hcccn+
1182	H₂CNCN	cyanamide, methylene	ch2ncn
1183	HNCCNH	Ethenediimine	hnccnh
1184	C₃H₃N	acrylonitrile	ch2chcn
1185	C₃H₃N⁺	acrylonitrile cation	ch2chcn+
1186	CH₃N₃	methyl azide	ch3n3
1187	NH₂CCNH₂	Diaminoacetylene	daa
1188	NH₂CH₂CN	Aminoacetonitrile	aan
1189	CH₃NHN₂⁺	methyl azide, protonated	ch3nhn2+
1190	C₂H₅CN	ethyl cyanide	c2h5cn
1191	CH₅N₃	Guanidine	guanidine
1192	C₄H₆	Bicyclo[1.1.0]butane	c157335
1193	CH₃NNCH₃	(Z)-1,2-Dimethyldiazene	dmdiazz
1194	H₂NCHCHNH₂	diaminoethylene	dae
1195	CH₆N₃⁺	guanidinium	ch6n3+
1196	C₃H₇N	Cyclopropylamine	cpram
1197	CH₇N₃	triaminomethane	tam
1198	C₃H₇N	Azetidine	azet
1199	C₄H₈	cyclobutane	cbutane
1200	C₂H₈N₂	Ethylenediamine	ethdiam
1201	CH₃NHNHCH₃	dimethyl hydrazine	dmh
1202	CH₃CH(NH₂)CH₃	2-Propanamine	pram2
1203	N(CH₃)₃	Trimethylamine	trimeam
1204	NH₂CH₂CH₂CH₃	1-Propanamine	pram1
1205	P(CH₃)₃	trimethylphosphine	tmp
1206	N(SiH₃)₃	trisilylamine	tsa
1207	As(CH₃)₃	trimethyl arsine	tmas
1208	(CH₃)₃NH⁺	protonated trimethyl amine	ptma
1209	C₃H₇NH₃⁺	n-propylamine, protonated	c3h7nh2
1210	Li₂O₂	dilithium dioxide	li2o2
1211	Na₂O₂	disodium dioxide	na2o2
1212	K₂O₂	dipotassium dioxide	k2o2
1213	C₃O	Tricarbon monoxide	c3o
1214	B₂O₂	Diboron dioxide	b2o2
1215	ONNO	NO dimer	onno
1216	CO₃	Carbon trioxide	co3
1217	CO₃^--	carbonate	co3--
1218	CS₃^--	Carbonotrithioate	cs3--
1219	NO₃	Nitrogen trioxide	no3
1220	NO₃^-	nitrate anion	no3-
1221	NO₃⁺	nitrogen trioxide cation	no3+
1222	SO₃	Sulfur trioxide	so3
1223	SO₃^-	Sulfur trioxide anion	so3-
1224	SO₃^--	Sulfate dianion	so3--
1225	SO₃⁺	Sulfur trioxide cation	so3+
1226	SeO₃	selenium trioxide	seo3
1227	S₄	Sulfur tetramer	s4
1228	TeO₃	Tellurium trioxide	teo3
1229	HCO₃^-	bicarbonate anion	hco3-
1230	HNO₃	Nitric acid	hno3
1231	HSO₃	Hydroxysulfonyl radical	hso3
1232	NH₂NO₂	nitramide	nh2no2
1233	C₂H₂CO	cyclopropenone	c2h2co
1234	C₃H₂O	Propadienal	c3h2o
1235	HCCCHO	2-propynal	hcccho
1236	C₂H₂O₂	Ethanedial	c2h2o2
1237	C₂H₂O₂⁺	Ethanedial cation	c2h2o2+
1238	H₂CO₃	Carbonic acid	h2co3
1239	H₂CS₃	thiocarbonic acid	h2cs3
1240	H₂NO₃⁺	Nitric Acid, Protonated	h2no3+
1241	H₂SO₃	Sulfurous acid	h2so3
1242	C₂H₃NO	Nitrosoethylene	c2h3no
1243	CH₃NCO	methylisocyante	ch3nco
1244	HOCH₂CN	cyanomethanol	hoch2cn
1245	CH₃COO^-	acetate anion	ch3coo-
1246	CH₃NO₂	Methane, nitro-	ch3no2
1247	CH₃ONO	Methyl nitrite	ch3ono
1248	NH₂COOH	Carbamic acid	nh2cooh
1249	H₃BO₃	Boric acid	h3bo3
1250	H₃AlO₃	Aluminum hydroxide	h3alo3
1251	H₃CO₃⁺	carbonic acid, protonated	h3co3+
1252	C₃H₄O	2-Propyn-1-ol	c107197
1253	C₃H₄O	allenol	c9000071
1254	C₃H₄O	Cyclopropanone	cpone
1255	C₃H₄O	Methylketene	c6004440
1256	CH₂CHCHO	Acrolein	c3h4o
1257	NH₂CONH₂	Urea	urea
1258	NH₂CONH₂⁺	Urea cation	urea+
1259	NH₂CSNH₂	Thiourea	thiourea
1260	C₂H₄O₂	1,3-dioxetane	c2h4o2
1261	CH₃COOH	Acetic acid	ch3cooh
1262	CH₃OCHO	methyl formate	ch3ocho
1263	CHOCH₂OH	hydroxy acetaldehyde	haa
1264	NH₂COOH₂⁺	Carbamic acid, O-protonated	nh2cooh2+
1265	NH₃COOH⁺	protonated Carbamic acid	nh3cooh+
1266	H₂OHCOOH	Water formic acid dimer 1	h2ohcooh_10
1267	H₂OHCOOH	Water formic acid dimer 2	h2ohcooh_11
1268	HCOOHH₂O	Formic acid water dimer	hcoohh2o
1269	HOCH₂OOH	hydroxy methyl peroxide	hoch2ooh
1270	CH₃COCH₂	Acetonyl radical	ch3coch2
1271	CH₂C(OH)NH₂	1-amino vinyl alchohol	ava
1272	CH₃C(OH)=NH	Ethaninidic acid	eia
1273	CH₃CHNOH	Acetaldoxime	acetaldoxime
1274	CH₃CONH₂	Acetamide	acetamide
1275	HCONHCH₃	N-methylformamide	nmfa
1276	CH₃CSNH₂	Ethanethioamide	ch3csnh2
1277	CH₅N₂O⁺	urea, N-protonated	ch4n2o+
1278	H₂NCOHNH₂⁺	urea, protonated	ureah+
1279	C₂H₅OO	ethylperoxy radical	c2h5oo
1280	CH₃NNCH₃	(E)-1,2-Dimethyldiazene	dmdiaze
1281	C₃H₅OH	Cyclopropanol	cproh
1282	C₃H₆O	2-Propen-1-ol	c107186
1283	C₃H₆O	Acetone enol	enol
1284	C₃H₆O	Oxetane	oxetane
1285	C₃H₆O	Propylene oxide	prox
1286	CH₃CH₂CHO	Propanal	propanal
1287	CH₃COCH₃	Acetone	acetone
1288	CH₃COCH₃^-	acetone anion	ch3coch3-
1289	C₃H₆S	Thietane	thietane
1290	C₃H₆S	Thiirane, methyl-	methiirane
1291	CH₃CSCH₃	Thioacetone	ch3csch3
1292	C₂H₆O₂	1,2-Ethanediol	ethdiol
1293	CH₃OOCH₃	dimethylperoxide	dmp
1294	CH₃SOCH₃	Dimethyl sulfoxide	dmso
1295	CH₂SHCH₂SH	1,2-Ethanedithiol	ethdisl
1296	CH₃SSCH₃	Disulfide, dimethyl	ch3ssch3
1297	CH₃COHCH₃⁺	acetone, protonated	acetoneh+
1298	HOCH₂CH₂NH₂	monoethanolamine	mea
1299	C₃H₇OH	1-Propanol	proh
1300	CH₃CHOHCH₃	Isopropyl alcohol	isoproh
1301	CH₃OC₂H₅	Ethane, methoxy-	etome
1302	C₃H₇SH	1-Propanethiol	prsh
1303	CH₃CHSHCH₃	2-Propanethiol	isoprsh
1304	CH₃SCH₂CH₃	Ethane, (methylthio)-	etsme
1305	H₂OCH₃OCH₃	water dimethylether dimer	h2och3och3
1306	Li₂F₂	Lithium fluoride dimer	li2f2
1307	Na₂F₂	Sodium Fluoride Dimer	na2f2
1308	Na₂Cl₂	Disodium dichloride	na2cl2
1309	C₂F₂	difluoroacetylene	c2f2
1310	C₂Cl₂	dichloroacetylene	c2cl2
1311	C₂Cl₂⁺	dichloroacetylene cation	c2cl2+
1312	FNO₂	Nitryl fluoride	fno2
1313	FONO	Nitrosyl hypofluorite	fono
1314	ClNO₂	Nitryl chloride	clno2
1315	ClONO	chlorine nitrite	clono
1316	BrONO	Bromine nitrite	brono
1317	N₂F₂	(Z)-Difluorodiazene	n2f2_z
1318	N₂F₂	Dinitrogen difluoride, (E)-	n2f2_e
1319	CF₂O⁺	Carbonic difluoride cation	f2co+
1320	COFCl	Carbonic chloride fluoride	cofcl
1321	CCl₂O	Phosgene	cl2co
1322	Cl₂CS	Thiophosgene	cl2cs
1323	COBr₂	Carbonic dibromide	cobr2
1324	BF₃	Borane, trifluoro-	bf3
1325	BF₃^-	Borane, trifluoro- anion	bf3-
1326	BF₃⁺	boron trifluoride cation	bf3+
1327	AlF₃	Aluminum trifluoride	alf3
1328	BClF₂	Chlorodifluoroborane	bclf2
1329	AlF₂Cl	Aluminum chloride difluoride	alclf2
1330	ScF₃	Scandium trifluoride	ScF3
1331	AlFCl₂	Aluminum dichloride fluoride	alcl2f
1332	BCl₃	Borane, trichloro-	bcl3
1333	BCl₃⁺	Boron Trichloride cation	bcl3+
1334	GaF₃	Gallium trifluoride	gaf3
1335	AlCl₃	Aluminum trichloride	alcl3
1336	GaCl₃	Gallium trichloride	gacl3
1337	BBr₃	Boron tribromide	bbr3
1338	AlBr₃	Aluminum Bromide	albr3
1339	ClO₃	Chlorine trioxide	clo3
1340	ClO₃^-	chlorate anion	clo3-
1341	BrO₃^-	Bromate anion	bro3-
1342	CF₃	Trifluoromethyl radical	cf3
1343	CF₃^-	Trifluoromethyl anion	cf3-
1344	CF₃⁺	Trifluoromethyl cation	cf3+
1345	CF₂Cl	difluorochloromethyl radical	cf2cl
1346	SiF₃	Silicon trifluoride radical	sif3
1347	SiF₃⁺	Silicon trifluoride cation	sif3+
1348	CFCl₂	dichlorofluoromethyl radical	cfcl2
1349	CCl₃	Trichloromethyl radical	ccl3
1350	CCl₃^-	Trichloromethyl anion	ccl3-
1351	CCl₃⁺	Trichloromethyl cation	ccl3+
1352	SiCl₃	trichlorosilyl radical	sicl3
1353	SiCl₃⁺	trichlorosilyl cation	sicl3+
1354	CBr₃	tribromomethyl radical	cbr3
1355	FOOF	Perfluoroperoxide	foof
1356	F₂SO	Thionyl Fluoride	f2so
1357	ClOOCl	Dichlorine dioxide	cloocl
1358	FSSF	Difluorodisulfane	fssf
1359	S₂F₂	Thio-thionyl fluoride	s2f2
1360	SOCl₂	thionyl chloride	socl2
1361	SSCl₂	Thiothionyl chloride	sscl2
1362	SeOCl₂	selenium oxychloride	seocl2
1363	NF₃	Nitrogen trifluoride	nf3
1364	NF₃^-	Nitrogen trifluoride anion	nf3-
1365	NF₃⁺	Nitrogen trifluoride cation	nf3+
1366	PF₃	Phosphorus trifluoride	pf3
1367	NCl₃	nitrogen trichloride	ncl3
1368	AsF₃	Arsenic trifluoride	asf3
1369	PCl₃	Phosphorus trichloride	pcl3
1370	SbF₃	Antimony Trifluoride	sbf3
1371	AsCl₃	Arsenous trichloride	ascl3
1372	SbCl₃	Antimony Trichloride	sbcl3
1373	NBr₃	Nitrogen Tribromide	nbr3
1374	PBr₃	Phosphorus tribromide	pbr3
1375	AsBr₃	Arsenic tribromide	asbr3
1376	NI₃	Nitrogen triiodide	ni3
1377	PI₃	Phosphorus triiodide	pi3
1378	ClSSCl	Disulfur dichloride	s2cl2
1379	SF₃	Sulfur trifluoride	sf3
1380	ClF₃	Chlorine trifluoride	clf3
1381	BrF₃	Bromine trifluoride	brf3
1382	IF₃	iodone trifluoride	if3
1383	HClO₃	Chloric Acid	hclo3
1384	CHF₂Cl	difluorochloromethane	chf2cl
1385	CHFCl₂	fluorodichloromethane	chfcl2
1386	CDCl₃	trichloromethane-d	cdcl3
1387	CHCl₃	Chloroform	chcl3
1388	CHBrF₂	Methane, bromodifluoro-	chbrf2
1389	SiHCl₃	Trichlorosilane	sihcl3
1390	CHFClBr	fluorochlorobromomethane	chfclbr
1391	CHBrCl₂	Methane, bromodichloro-	chbrcl2
1392	CHF₂I	difluoroiodomethane	chf2i
1393	CHBr₂F	dibromofluoromethane	chbr2f
1394	CHFClI	fluorochloroiodomethane	chfcli
1395	CHCl₂I	dichloroiodomethane	chcl2i
1396	CHClBr₂	Methane, dibromochloro-	chclbr2
1397	CHBr₃	bromoform	chbr3
1398	CHI₃	Iodoform	chi3
1399	NF₃H⁺	protonated nitrogen trifluoride	nf3h+
1400	AsF₃H⁺	Arsenic trifluoride, protonated	asf3h+
1401	C₂H₂F₂	Ethene, 1,2-difluoro-, (E)-	c2h2f2e
1402	C₂H₂F₂	Ethene, 1,2-difluoro-, (Z)-	c2h2f2z
1403	CH₂CF₂	Ethene, 1,1-difluoro-	ch2cf2
1404	C₂H₂ClF	1-chloro-1-fluoroethylene	c2h2clf
1405	CHFCHCl	(E)-1-chloro-2-fluoroethene	chfchcle
1406	CHFCHClz	(Z)-1-Chloro-2-fluoroethene	chfchclz
1407	CH₂CCl₂	Ethene, 1,1-dichloro-	ch2ccl2
1408	CHClCHCl	Ethene, 1,2-dichloro-, (E)-	chclchcle
1409	CHClCHCl	Ethene, 1,2-dichloro-, (Z)-	chclchclz
1410	C₂H₂Br₂	1,1-dibromoethene	c2h2br2
1411	CHBrCHBr	Ethene, 1,2-dibromo-, (E)-	chbrchbre
1412	CHBrCHBr	Ethene, 1,2-dibromo-, (Z)-	chbrchbrz
1413	CH₂FCHO	Fluoroacetaldehyde	ch2fcho
1414	CH₃COF	Acetyl fluoride	ch3cof
1415	CH₂ClCHO	chloroacetaldehyde	ch2clcho
1416	CH₃COCl	Acetyl Chloride	ch3cocl
1417	C₂H₄F₂	1,2-difluoroethane	c2h4f2
1418	CH₃CHF₂	Ethane, 1,1-difluoro-	ch3chf2
1419	CH₂FCH₂Cl	Ethane, 1-chloro-2-fluoro-	ch2fch2cl
1420	CH₃CHFCl	Ethane, 1-chloro-1-fluoro-	ch3chfcl
1421	CH₂ClCH₂Cl	Ethane, 1,2-dichloro-	ch2clch2cl
1422	CH₃CHCl₂	Ethane, 1,1-dichloro-	ch3chcl2
1423	CH₂BrCH₂Cl	1-bromo-2-chloroethane	ch2brch2cl
1424	CH₂BrCH₂Br	Ethane, 1,2-dibromo-	ch2brch2br
1425	CH₂CFCH₃	2-fluoropropene	2fpro
1426	CH₂CHCH₂F	Allyl Fluoride	allylf
1427	CH₃CHCHF	trans-1-Fluoro-1-propene	propene1ft
1428	C₃H₅Cl	1-Propene, 3-chloro-	prop1cl3
1429	C₃H₅Cl	1-chloro-1-propene(E)	prop1cl1e
1430	C₃H₅Cl	1-chloro-1-propene(Z)	prop1cl1z
1431	CH₂FCH₂OH	2-fluoroethanol	ch2fch2oh
1432	CH₂ClCH₂OH	2-Chloroethanol	ch2clch2oh
1433	CH₂ClCH₂OH₂⁺	2-chloroethanol, protonated	ch2clch2oh2+
1434	CH₂FCH₂CH₃	1-Fluoropropane	prf1
1435	CH₃CHFCH₃	2-Fluoropropane	prf2
1436	CH₂ClCH₂CH₃	Propane, 1-chloro-	prcl1
1437	CH₃CHClCH₃	Propane, 2-chloro-	prcl2
1438	CH₃CH₂CH₂Br	n-propyl bromide	prbr
1439	CH₃CHBrCH₃	i-propyl bromide	iprbr
1440	C₃H₉O⁺	trimethyl oxonium cation	c3h9o+
1441	B₅H₉	pentaborane9	b5h9
1442	C₅H₄	pentatetraene	ptrene
1443	C₅H₅	cyclopentadienyl radical	c5h5
1444	C₅H₅^-	cylopentadienyl anion	c5h5-
1445	C₅H₆	1,3-Cyclopentadiene	c542927
1446	C₅H₆	1-Buten-3-yne, 2-methyl-	c78808
1447	C₅H₆	3-Penten-1-yne, (E)-	c2004695
1448	C₅H₆	3-Penten-1-yne, (Z)-	c1574409
1449	C₅H₆	Bicyclo[2.1.0]pent-2-ene	c5164352
1450	C₅H₆	Cyclopropylacetylene	c6746947
1451	C₅H₆	Propellane	propellane
1452	C₅H₇	1,3-pentadienyl radical	pdyl
1453	C₅H₇	cyclopentenyl radical	cpyl
1454	C₅H₈	1,2-Butadiene, 3-methyl-	c598254
1455	C₅H₈	1,2-Pentadiene	c591957
1456	C₅H₈	1,3-Butadiene, 2-methyl-	c78795
1457	C₅H₈	1,3-Pentadiene, (E)-	c2004708
1458	C₅H₈	1,3-Pentadiene, (Z)-	c1574410
1459	C₅H₈	1,4-Pentadiene	c591935
1460	C₅H₈	1-pentyne	a1pentyne
1461	C₅H₈	2,3-Pentadiene	c591968
1462	C₅H₈	Bicyclo[1.1.1]pentane	bcp
1463	C₅H₈	Cyclobutane, methylene-	c1120565
1464	C₅H₈	Cyclopentene	c142290
1465	C₅H₈	Ethenylcyclopropane	c693867
1466	CH₃CCCH₂CH₃	2-Pentyne	2pentyne
1467	C₅H₁₀	1-Butene, 2-methyl-	c563462
1468	C₅H₁₀	2-Butene, 2-methyl-	c513359
1469	C₅H₁₀	2-Pentene, (E)-	c646048
1470	C₅H₁₀	2-Pentene, (Z)-	c627203
1471	C₅H₁₀	Cyclopentane	c287923
1472	C₅H₁₀	Cyclopropane, 1,1-dimethyl-	c1630940
1473	CH₂CHCH₂CH₂CH₃	1-pentene	pentene
1474	C₅H₁₁	2-Methylbut-2-yl radical	c4348350
1475	C₅H₁₂	Butane, 2-methyl-	buta2
1476	C₅H₁₂	Pentane	pentane
1477	C₅H₁₂	Propane, 2,2-dimethyl-	neopentane
1478	Si(CH₃)₄	tetramethylsilane	tms
1479	N₂O₃	Dinitrogen trioxide	n2o3
1480	C₃H₂N₂	Malononitrile	c3h2n2
1481	CH₂N₄	1H-Tetrazole	1htz
1482	C₃H₃N₂	imidazolyl radical	im
1483	C₃H₃N₂^-	imidizolyl anion	im-
1484	C₂H₃N₃	1H-1,2,4-Triazole	c288880
1485	C₄H₄N	pyrrolide radical	c4h4n
1486	C₄H₄N^-	pyrrolide anion	c4h4n-
1487	C₃H₄N₂	1H-Imidazole	1himidaz
1488	C₃H₄N₂	1H-Pyrazole	1hpyraz
1489	C₃H₄N₂	2H-Imidazole	imid2h
1490	C₃H₄N₂	4H-Imidazole	imid4h
1491	C₄H₅N	(E)-2-Butenenitrile	c627269
1492	C₄H₅N	(Z)-2-Butenenitrile	c1190767
1493	C₄H₅N	2H-pyrrole	pyrrole2
1494	C₄H₅N	3H-pyrrole	pyrrole3
1495	C₄H₅N	Cyclopropanecarbonitrile	c5500210
1496	C₄H₅N	Pyrrole	pyrrole
1497	CH₂CHCH₂CN	Allylcyanide	ch2chch2cn
1498	C₄H₆N⁺	pyrrole, alpha-protonated	appyr
1499	C₄H₆N⁺	pyrrole, beta-protonated	bppyr
1500	C₄H₆N⁺	pyrrole, protonated	ppyr
1501	C₃H₆N₂	3-Aminopropionitrile	c151188
1502	CH₃CH(CH₃)CN	Propanenitrile, 2-methyl-	c4h7n
1503	CH₃CH₂CH₂CN	Butanenitrile	c109740
1504	C₅H₈	Bicyclo[2.1.0]pentane	c185944
1505	C₅H₈	Spiropentane	c157404
1506	C₄H₉N	Cyclobutylamine	cbam
1507	C₄H₉N	Pyrrolidine	pyrrolidine
1508	C₃H₁₀N₂	1,2-Diaminopropane	diampr12
1509	C(CH₃)₃NH₂	2-Propanamine, 2-methyl-	c75649
1510	C(NH₂)H₂C(CH₃)HCH₃	1-Propanamine, 2-methyl-	c78819
1511	C(NH₂)H₂CH₂CH₂CH₃	1-Butanamine	butam1
1512	CH₃C(NH₂)HCH₂CH₃	2-Butanamine	butam2
1513	NH(C₂H₅)₂	diethylamine	dea
1514	NC₄H₁₂⁺	tetramethyl ammonium cation	nc4h12+
1515	C₃O₂	Carbon suboxide	c3o2
1516	C₃O₂⁺	Carbon suboxide cation	c3o2+
1517	B₂O₃	diboron trioxide	b2o3
1518	MgCO₃	Magnesium Carbonate	mgco3
1519	BeCO₃	Beryllium Carbonate	beco3
1520	CaCO₃	Calcium Carbonate	caco3
1521	ONONO	Nitrosyl nitrite	onono
1522	PO₄^---	phosphate	po4---
1523	SO₄^--	sulfate	so4--
1524	HOONO₂	peroxy nitric acid	hoono2
1525	HSO₄^-	bisulfate anion	hso4-
1526	C₂H₂N₂S	1,3,4-Thiadiazole	c2h2n2s
1527	C₃H₂O₂	Propiolic acid	c3h2o2
1528	CHOCOOH	oxo acetic acid	oaa
1529	CHOOCHO	diformyl ether	choocho
1530	H₂SO₄	Sulfuric acid	h2so4
1531	H₂SeO₄	Selenic acid	h2seo4
1532	C₃H₃NO	Isoxazole	isox
1533	C₃H₃NO	Oxazole	oxazole
1534	C₃H₃NS	Thiazole	thiazole
1535	CH₃C(O)OO	acetyl peroxy radical	ch3coo2
1536	CH₃NO₃	Methyl nitrate	ch3no3
1537	H₃PO₄	Phosphoric Acid	h3po4
1538	C₄H₄O	Furan	furan
1539	C₄H₄O⁺	Furan cation	furan+
1540	CH₃COCCH	3-butyn-2-one	c1423605
1541	C₄H₄S	Thiophene	furans
1542	C₄H₄Se	selenophene	c4h4se
1543	C₃H₄O₂	β–Propiolactone	beta
1544	C₃H₄O₂	2-Propenoic acid	propenoic2
1545	C₃H₄O₂	Methyl glyoxal	megly
1546	C₃H₄O₂	propanedial	propanedial
1547	C₃H₄O₂	propenalol	propenalol
1548	HOCHCCHOH	allenediol	aldiol
1549	C₂H₄O₃	1,2,3-trioxolane	c2h4o3
1550	C₂H₄O₃	trioxolane124	triox
1551	HOCH₂COOH	Hydroxyacetic acid	hac
1552	CH₂CHCONH₂	Acrylamide	c79061
1553	CH₃OCH₂CN	Methoxyacetonitrile	c1738369
1554	CH₅N₃S	Hydrazinecarbothioamide	c79196
1555	H₂NCH₂COOH	Glycine	glycine
1556	CH₃SO₂NH₂	methanesulfonamide	ch3so2nh2
1557	C₄H₆O	cis-2-butenal	butenal2c
1558	C₄H₆O	Cyclobutanone	cbutone
1559	C₄H₆O	Furan, 2,3-dihydro-	furan23h
1560	C₄H₆O	Furan, 2,5-dihydro-	furan25h
1561	CH₂CHOCHCH₂	Vinyl ether	vinylether
1562	CHOCHCHCH₃	2-Butenal	butenal2
1563	C₄H₆S	Thiophene, 2,3-dihydro-	thiop23h
1564	C₄H₆S	Thiophene, 2,5-dihydro-	thiop25h
1565	CH₂CHSCHCH₂	Divinyl sulfide	divis
1566	C₂H₆N₂O	Urea, methyl-	c598505
1567	C₃H₆O₂	1,3-Dioxolane	dioxolane
1568	CH₃CH₂COOH	Propanoic Acid	propanoic
1569	CH₃COOCH₃	methyl acetate	aame
1570	HCOOC₂H₅	Ethyl formate	faee
1571	C₂H₆O₂S	Dimethyl sulfone	c67710
1572	CH₃SSSCH₃	dimethyl trisulfide	c2h6s3
1573	C₃H₇NO	dimethylformamide	dmf
1574	C₃H₇NO	Propanamide	propanam
1575	C₂H₃OC₂H₅	Ethene, ethoxy-	c109922
1576	C₄H₈O	Cyclobutanol	c2919235
1577	C₄H₈O	Furan, tetrahydro-	thf
1578	CH₂C(CH₃)OCH₃	1-Propene, 2-methoxy-	pre1meo2
1579	CH₃COCH₂CH₃	2-Butanone	buta2one
1580	CHOCH(CH₃)CH₃	Propanal, 2-methyl-	c78842
1581	CHOCH₂CH₂CH₃	Butanal	butanal
1582	C₄H₈S	Thiophene, tetrahydro-	tht
1583	C₃H₈O₂	1,3-Propanediol	c504632
1584	C₃H₈O₂	Hydroperoxide, 1-methylethyl	c3031752
1585	C₃H₈O₂	Methane, dimethoxy-	c109875
1586	C₃H₈O₂	Propylene glycol	c57556
1587	C₃H₈S₂	1,3-Propanedithiol	c109808
1588	C₄H₁₀O	1-Butanol	butanol1
1589	C₄H₁₀O	1-Propanol, 2-methyl-	c78831
1590	C₄H₁₀O	2-Butanol, (.+/-.)-	butanol2
1591	C₄H₁₀O	Ethanol, 1,1-dimethyl-	tbuoh
1592	C₄H₁₀O	Ethoxy ethane	etoet
1593	C₄H₁₀O	Methyl propyl ether	meopr
1594	C₄H₁₀O	Propane, 2-methoxy-	c598538
1595	C₄H₁₀O⁺	1-Butanol cation	butanol1+
1596	C(CH₃)₃SH	2-Propanethiol, 2-methyl-	tbush
1597	C₂H₅SC₂H₅	Diethyl sulfide	etset
1598	C₄H₉SH	1-Butanethiol	bush
1599	CH₂(SH)CH(CH₃)CH₃	1-Propanethiol, 2-methyl-	c513440
1600	CH₃C(SCH₃)HCH₃	Propane, 2-(methylthio)-	mesipr
1601	CH₃CH(SH)CH₂CH₃	2-Butanethiol	butansl2
1602	FNO₃	Fluorine nitrate	fno3
1603	ClONO₂	Chlorine nitrate	clono2
1604	BrONO₂	Bromine nitrate	brono2
1605	TiCl₄	Titanium tetrachloride	ticl4
1606	ClO₄^-	perchlorate anion	clo4-
1607	BF₄^-	tetrafluoroboron anion	bf4-
1608	ClFO₃	Perchloryl fluoride	clfo3
1609	SO₂F₂	Sulfuryl fluoride	so2f2
1610	SO₂Cl₂	Sulfuryl chloride	so2cl2
1611	F₃NO	Nitrogen trifluoride oxide	f3no
1612	F₃PO	Phosphoryl fluoride	pf3o
1613	Cl₃PO	Phosphoryl chloride	pcl3o
1614	CF₄	Carbon tetrafluoride	cf4
1615	CF₃Cl	Methane, chlorotrifluoro-	cf3cl
1616	SiF₄	Silicon tetrafluoride	sif4
1617	CF₂Cl₂	difluorodichloromethane	cf2cl2
1618	TiF₄	Titanium tetrafluoride	tif4
1619	CFCl₃	Trichloromonofluoromethane	cfcl3
1620	CF₃Br	Bromotrifluoromethane	cf3br
1621	GeF₄	Germanium tetrafluoride	gef4
1622	CCl₄	Carbon tetrachloride	ccl4
1623	CCl₄⁺	Carbon tetrachloride cation	ccl4+
1624	CBrClF₂	Methane, bromochlorodifluoro-	cbrclf2
1625	SiCl₄	Silane, tetrachloro-	sicl4
1626	CBrCl₂F	bromodichlorofluoromethane	cbrcl2f
1627	CF₃I	trifluoroiodomethane	cf3i
1628	CBrCl₃	Methane, bromotrichloro-	cbrcl3
1629	CBr₂F₂	Methane, dibromodifluoro-	cbr2f2
1630	GeCl₄	Germanium Tetrachloride	gecl4
1631	CBr₂ClF	dibromochlorofluoromethane	cbr2clf
1632	CBr₂Cl₂	dibromodichloromethane	cbr2cl2
1633	CCl₃I	trichloroiodomethane	ccl3i
1634	CFBr₃	fluorotribromomethane	cfbr3
1635	CFClBrI	fluorochlorobromoiodomethane	cfclbri
1636	CBr₃Cl	tribromochloromethane	cbr3cl
1637	CF₂I₂	difluorodiiodomethane	cf2i2
1638	CBr₄	Carbon tetrabromide	cbr4
1639	CCl₂I₂	dichlorodiiodomethane	ccl2i2
1640	SiBr₄	Silicon tetrabromide	sibr4
1641	CBr₃I	tribromoiododmethane	cbr3i
1642	GeBr₄	Germanium tetrabromide	gebr4
1643	CI₄	tetraiodomethane	ci4
1644	SiI₄	silicon tetraiodide	sii4
1645	ClOF₃	Chlorine trifluoride oxide	clof3
1646	SF₄	Sulfur tetrafluoride	sf4
1647	SeF₄	Selenium tetrafluoride	sef4
1648	SCl₄	Sulfur tetrachloride	scl4
1649	C₂HF₃	Trifluoroethylene	c2hf3
1650	C₂HF₃⁺	Trifluoroethylene cation	c2hf3+
1651	CHClCCl₂	Trichloroethylene	chclccl2
1652	CHBrCF₂	1-Bromo-2,2-difluoroethylene	chbrcf2
1653	HClO₄	perchloric acid	hclo4
1654	HSO₃F	Fluorosulfonic acid	hso3f
1655	CF₃OH	trifluoromethanol	cf3oh
1656	CH₂ClCCCl	1,3-dichloropropyne	ch2clcccl
1657	CHClCCHCl	1,3-dichloroallene	chclcchcl
1658	CHCl₂CCH	3,3-dichloropropyne	chcl2cch
1659	CHCl₂CHO	dichloroacetaldehyde	chcl2cho
1660	PF₃CH₂	phosphorane, trifluoromethylene-	pf3ch2
1661	CH₃CF₃	Ethane, 1,1,1-trifluoro-	ch3cf3
1662	CHF₂CH₂F	Ethane, 1,1,2-trifluoro	ch2fchf2
1663	CH₃CF₂Cl	1-Chloro-1,1-Difluoroethane	ch3cf2cl
1664	CH₃CFCl₂	1,1-Dichloro-1-fluoroethane	ch3cfcl2
1665	CH₂ClCHCl₂	1,1,2-trichloroethane	ch2clchcl2
1666	CH₃CCl₃	Ethane, 1,1,1-trichloro-	ch3ccl3
1667	SiCl₃CH₃	methyltrichlorosilane	sicl3ch3
1668	CH₃CBr₃	1,1,1-tribromoethane	ch3cbr3
1669	NH₃BCl₃	Amminetrichloroboron	nh3bcl3
1670	SiH₃CCl₃	(trichloromethyl)silane	sih3ccl3
1671	CH₂CClCHCH₂	1,3-Butadiene, 2-chloro-	c4h5cl
1672	C₃H₅ClO	Oxirane, (chloromethyl)-	c106898
1673	CH₂FCH₂CH₂F	1,3-difluoropropane	ch2fch2ch2f
1674	CH₃CF₂CH₃	2,2-difluoropropane	ch3cf2ch3
1675	CH₂ClCH₂CH₂Cl	1,3-dichloropropane	prdicl13
1676	CH₂ClCHClCH₃	Propane, 1,2-dichloro-	prdicl12
1677	CH₃CCl₂CH₃	Propane, 2,2-dichloro-	prdicl22
1678	CHCl₂CH₂CH₃	1,1-dichloropropane	prdicl11
1679	SiCl₂(CH₃)₂	dichlorodimethylsilane	sicl2me2
1680	CH₂CClCH₂CH₃	1-Butene, 2-chloro-	bute1cl2
1681	CH₂CHCH₂CH₂Cl	1-Butene, 4-chloro-	bute1cl4
1682	CH₂CHCHClCH₃	1-Butene, 3-chloro-	bute1cl3
1683	CH₂ClCHCHCH₃	2-Butene, 1-chloro-	bute2cl1
1684	CH₃CClCHCH₃	2-Butene, 2-chloro-, (E)-	bute2cl2e
1685	CH₃CClCHCH₃	2-Butene, 2-chloro-, (Z)-	bute2cl2z
1686	CHClCHCH₂CH₃	(E)-1-Chloro-1-butene	bute1cl1
1687	CHClCHCH₂CH₃	(Z)-1-Chloro-1-butene	bute1cl1z
1688	C₄H₉F	1-fluorobutane	butaf1
1689	CH₃CHFCH₂CH₃	2-fluorobutane	butaf2
1690	CH₂ClCH₂CH₂CH₃	Butane, 1-chloro-	butacl1
1691	CH₃CCl(CH₃)CH₃	Propane, 2-chloro-2-methyl-	procl2me2
1692	CH₃CHClCH₂CH₃	Butane, 2-chloro-	butacl2
1693	XeF₄	Xenon tetrafluoride	xef4
1694	C₂H₂N₂O	Furazan	furazan
1695	CF₃PH₂	phosphine, (trifluoromethyl)-	cf3ph2
1696	NH₃BF₃	Amminetrifluoroboron	nh3bf3
1697	C₆H₂	hexatriyne	c6h2
1698	C₆H₄	(E)-Hexa-1,5-diyne-3-ene	c6h4e
1699	C₆H₄	(Z)-Hexa-1,5-diyne-3-ene	c6h4z
1700	C₆H₄	Benzyne	benzyne
1701	C₆H₅	phenyl	phenyl
1702	C₆H₅^-	phenyl anion	phenyl-
1703	C₆H₆	Prismane	prismane
1704	C₆H₆	1,2,4,5-Hexatetraene	ht1245
1705	C₆H₆	2,4-Hexadiyne	hexadiyne
1706	C₆H₆	3,4-Dimethylenecyclobutene	cb34m
1707	C₆H₆	Benzene	benzene
1708	C₆H₆	Benzvalene	bv
1709	C₆H₆	Dewar Benzene	dewar
1710	C₆H₆	Hexa-1,5-diene-3-yne	hdy153
1711	C₆H₆	Trimethylenecycopropane	tmcp
1712	C₆H₆⁺	Benzene cation	c6h6+
1713	C₆H₇⁺	benzene, protonated	c6h7+
1714	C₆H₈	(E)-hexa-1,3,5-triene	c821078
1715	C₆H₈	(E)-hexa-2,3,4-triene	c59660650
1716	C₆H₈	(Z)-hexa-1,3,5-triene	hexatri135
1717	C₆H₈	(Z)-hexa-2,3,4-triene	hetr234c
1718	C₆H₈	1,3-Cyclohexadiene	cyhexadiene13
1719	C₆H₈	1,4-Cyclohexadiene	cyhexadiene14
1720	C₆H₈	3-Methylenecyclopentene	c930267
1721	C₆H₈	Bicyclo[2.1.1]hex-2-ene	c822413
1722	C₆H₈	Bicyclo[2.2.0]hex-1(4)-ene	c30830207
1723	C₆H₈	Bicyclo[3.1.0]hex-2-ene	c694019
1724	C₆H₁₀	1,3-Hexadiene, (E)-	hexdi13e
1725	C₆H₁₀	1,3-Hexadiene, (Z)-	hexdi13z
1726	C₆H₁₀	1,4-Hexadiene, (E)-	hexdi14t
1727	C₆H₁₀	1,4-Hexadiene, (Z)-	hexdi14z
1728	C₆H₁₀	1,5-Hexadiene	c592427
1729	C₆H₁₀	1-Butyne, 3,3-dimethyl-	c917920
1730	C₆H₁₀	1-Hexyne	hexyne1
1731	C₆H₁₀	2,4-Hexadiene, (E,E)-	hexdi24ee
1732	C₆H₁₀	2,4-Hexadiene, (E,Z)-	hexdi24ez
1733	C₆H₁₀	2,4-Hexadiene, (Z,Z)-	hexdi24zz
1734	C₆H₁₀	2-Hexyne	c764352
1735	C₆H₁₀	3-Hexyne	hexyne3
1736	C₆H₁₀	cyclohexene	cyclohexene
1737	C₆H₁₀	Cyclopentene, 1-methyl-	c693890
1738	C₆H₁₀	Cyclopentene, 3-methyl-	c1120623
1739	C₆H₁₀	Cyclopentene, 4-methyl-	c1759815
1740	C₄H₆(CH₃)₂	1,1-dimethylcyclobutane	dmcb11
1741	C₆H₁₂	(1R,2R)-1,2-dimethylcyclobutane	dmcb12t
1742	C₆H₁₂	(1r,3r)-1,3-dimethylcyclobutane	dmcb13t
1743	C₆H₁₂	(E)-2-Hexene	e2hexene
1744	C₆H₁₂	(E)-3-methylpent-2-ene	c616126
1745	C₆H₁₂	(E)-hex-3-ene	e3hexene
1746	C₆H₁₂	(Z)-3-methylpent-2-ene	c922623
1747	C₆H₁₂	(Z)-hex-2-ene	z2hexene
1748	C₆H₁₂	(Z)-hex-3-ene	z3hexene
1749	C₆H₁₂	2,3-dimethylbut-1-ene	c563780
1750	C₆H₁₂	2,3-dimethyl-but-2-ene	tmeet
1751	C₆H₁₂	3-methylenepentane	c760214
1752	C₆H₁₂	cis-1,2-dimethylcyclobutane	dmcb12c
1753	C₆H₁₂	cis-1,3-dimethylcyclobutane	dmcb13c
1754	C₆H₁₂	Cyclohexane	cyclohexane
1755	C₆H₁₂	Cyclopentane, methyl-	c96377
1756	C₆H₁₂	Ethylcyclobutane	c4806615
1757	C₆H₁₂	hex-1-ene	hexene1
1758	C₆H₁₄	Butane, 2,2-dimethyl-	buta22
1759	C₆H₁₄	Butane, 2,3-dimethyl-	buta23
1760	C₆H₁₄	Hexane	hexane
1761	C₆H₁₄	Pentane, 2-methyl-	penta2
1762	C₆H₁₄	Pentane, 3-methyl-	penta3
1763	C₄N₂	2-Butynedinitrile	c4n2
1764	N₃P₃	1,3,5,2,4,6-Triazatriphosphorine	n3p3
1765	C₄H₂N₂	Fumaronitrile	c4h2n2
1766	C₂H₂N₄	sym-tetrazine	ttz
1767	C₃H₃N₃	1,3,5-Triazine	triazine135
1768	CH₃N₅	5-Aminotetrazole	c4418615
1769	C₄H₄N₂	1,3-Diazine	diazine13
1770	C₄H₄N₂	Pyrazine	pyrazine
1771	C₄H₄N₂	Pyridazine	pyridazine
1772	C₄H₄N₂	Succinonitrile	c110612
1773	C₂H₄N₄	1H-Tetrazole, 1-methyl-	c16681779
1774	C₂H₄N₄	1H-Tetrazole, 5-methyl-	c4076362
1775	C₂H₄N₄	2H-Tetrazole, 2-methyl-	c16681780
1776	C₅H₅N	Bicyclo[1.1.0]butane-1-carbonitrile	bibucn
1777	C₅H₅N	E-2,4-pentadienenitrile	bdcn
1778	C₅H₅N	Pyridine	pyridine
1779	B₃N₃H₆	borazine	borazine
1780	C₆H₆	Fulvene	fulvene
1781	C₅H₆N⁺	Pyridinium	c5h6n
1782	C₄H₆N₂	1H-Imidazole, 2-methyl-	c693981
1783	C₅H₇N	(E)-2-Pentenenitrile	c26294984
1784	C₅H₇N	(E)-3-Pentenenitrile	c16529661
1785	C₅H₇N	(Z)-2-Pentenenitrile	c25899507
1786	C₅H₇N	1H-Pyrrole, 1-methyl-	c96548
1787	C₅H₇N	Cyclobutanecarbonitrile	c4426113
1788	C₅H₉N	1,2,3,6-Tetrahydropyridine	c694053
1789	C₅H₉N	Butanenitrile, 2-methyl-	c18936179
1790	C₅H₉N	Pentanenitrile	c110598
1791	C₅H₉N	Propanenitrile, 2,2-dimethyl-	c630182
1792	C₆H₁₀	Bicyclo[3.1.0]hexane	c285585
1793	C₅H₁₁N	Cyclopentanamine	cypentam
1794	C₅H₁₁N	Piperidine	piper
1795	C₄H₁₂N₂	1,2-Butanediamine	c4426486
1796	C₄H₁₂N₂	2-Methyl-1,2-propanediamine	c811938
1797	Li₂CO₃	Lithium Carbonate	li2co3
1798	Na₂CO₃	Sodium Carbonate	na2co3
1799	C₂O₄^--	oxalate anion	c2o4
1800	MgSO₄	Magnesium Sulfate	mgso4
1801	N₂O₄	Dinitrogen tetroxide	n2o4
1802	C₃H₂O₃	vinylene carbonate	vica
1803	C₂H₂O₄	Oxalic Acid	oxalic
1804	C₂H₃NO₃	Oxamic acid	oxamic
1805	C₄H₄O₂	2(5H)-Furanone	furanone
1806	C₄H₄O₂	2-Oxetanone, 4-methylene-	c674828
1807	C₂H₄N₂O₂	Oxalamide	oxalamide
1808	C₂H₄N₂S₂	Ethanedithioamide	c79403
1809	C₂H₄CO₃	Ethylene carbonate	etco3
1810	C₃H₄O₂S	2H-Thiete-1,1-dioxide	c7285327
1811	C₃H₄S₃	1,3-Dithiolane-2-thione	c822388
1812	C₂H₄O₄	Formic acid dimer	fadimer
1813	C₄H₅NO	3-Methylisoxazole	isox3m
1814	C₄H₅NO	Isoxazole, 5-methyl-	c5765446
1815	C₄H₅NS	4-Methylthiazole	c693958
1816	C₂H₅NO₃	Nitric acid, ethyl ester	c625581
1817	C₅H₆O	2H-Pyran	pyran2
1818	C₅H₆O	2-methylfuran	furan2m
1819	C₅H₆O	3-Methylfuran	furan3m
1820	C₅H₆O	Pentadienal	pdal
1821	C₅H₆S	Thiophene, 2-methyl-	c554143
1822	C₅H₆S	Thiophene, 3-methyl-	c616444
1823	C₄H₆O₂	γ–Butyrolactone	c96480
1824	C₄H₆O₂	2,3-Butanedione	c431038
1825	C₄H₆O₂	2-Propenoic acid, methyl ester	c96333
1826	C₄H₆O₂	Crotonic Acid	crot
1827	C₄H₆OS	2,3-dihydrothiophene-2-ol	c9000117
1828	C₄H₆OS	2,5-dihydrothiophene-3-ol	c9000093
1829	C₄H₆OS	4,5-dihydrothiophene-2-ol	c9000106
1830	C₄H₆OS	4,5-dihydrothiophene-3-ol	c9000082
1831	C₄H₆OS	Dihydro-2-(3H)-thiophenone	c1003107
1832	C₄H₆OS	Dihydro-3-(2H)-thiophenone	c1003049
1833	C₄H₆OS	Vinyl sulfoxide	c1115157
1834	CH₆N₄S	Carbonothioic dihydrazide	thiacarb
1835	C₂H₆N₂O₂	(E)-Azodioxymethane	c37765154
1836	C₂H₆N₂O₂	Dimethylnitroamine	c4164287
1837	C₃H₆O₃	1,3,5-Trioxane	trioxane
1838	C₃H₆S₃	1,3,5-Trithiane	c3h6s3
1839	C₃H₆S₃	Carbonotrithioic acid, dimethyl ester	c2314489
1840	C₂H₆O₃S	Sulfurous acid, dimethyl ester	c616422
1841	C₄H₇NO	2-Pyrrolidinone	c616455
1842	C₄H₇NO	Ethoxyacetonitrile	etoaccn
1843	C₄H₇NO	Methacrylamide	c79390
1844	C₄H₇NO	Oxazole, 4,5-dihydro-2-methyl-	c1120645
1845	HCONH₂CN₂H₄	formamide aminomethanimine dimer	d13
1846	C₃H₇ONO	Propyl nitrite	prono
1847	CH₃CH(CH₃)ONO	Isopropyl nitrite	c541424
1848	CH₃CH(NH₂)COOH	Alanine	alanine
1849	CH₃NHCH₂COOH	Sarcosine	sarcosine
1850	NH₂CH₂CH₂COOH	β–alanine	betaalanine
1851	NH₂COOC₂H₅	Urethane	urethane
1852	C₅H₈O	2H-Pyran, 3,4-dihydro-	c110872
1853	C₅H₈O	Cyclopentanone	c120923
1854	C₅H₈O	Furan, 2,3-dihydro-5-methyl-	c1487156
1855	C₅H₈O	Methyl cyclopropyl ketone	c765435
1856	N(CH₃)₂CONH₂	Urea, N,N-dimethyl-	c598947
1857	NH(CH₃)CONH(CH₃)	Urea, N,N'-dimethyl-	c96311
1858	NH₂CONHC₂H₅	Urea, ethyl-	c625525
1859	C₄H₈O₂	1,3-Dioxane	dioxan13
1860	C₄H₈O₂	1,3-Dioxolane, 2-methyl-	c497267
1861	C₄H₈O₂	1,4-Dioxane	dioxan14
1862	C₄H₈O₂	Ethene, 1,1-dimethoxy-	c922690
1863	C₄H₈O₂	Ethyl acetate	c141786
1864	C₄H₈OS	s-Ethyl thioacetate	c625605
1865	C₃H₈O₃	1,2,3-Propanetriol	glycerin
1866	C₃H₈O₂S	(Methylsulfonyl)ethane	c594434
1867	C₄H₉NO	Butanamide	c541355
1868	C₄H₉NO	Propanamide, 2-methyl-	c563837
1869	C₅H₁₀O	2-Butanone, 3-methyl-	c563804
1870	C₅H₁₀O	2H-Pyran, tetrahydro-	c142687
1871	C₅H₁₀O	2-methylbutyraldehyde	2meba
1872	C₅H₁₀O	2-Pentanone	mpk
1873	C₅H₁₀O	3-Pentanone	dek
1874	C₅H₁₀O	Cyclopentanol	c96413
1875	C₅H₁₀O	Oxetane, 3,3-dimethyl-	c6921353
1876	C₅H₁₀O	Pentanal	pal
1877	C₅H₁₀S	2H-Thiopyran, tetrahydro-	c1613510
1878	C₅H₁₀S	3-Ethylthio-1-propene	c5296628
1879	C₅H₁₀S	Cyclopentanethiol	c1679078
1880	C₅H₁₀S	Thiophene, tetrahydro-2-methyl-	c1795091
1881	C₅H₁₀S	Thiophene, tetrahydro-3-methyl-	c4740005
1882	C₄H₁₀O₂	1,1-Dimethoxyethane	c534156
1883	C₄H₁₀O₂	1,3-Butanediol	budiol13
1884	C₄H₁₀O₂	1,4-Butanediol	budiol14
1885	C₄H₁₀O₂	Ethane, 1,2-dimethoxy-	c110714
1886	C₄H₁₀OS	Diethyl sulfoxide	c70291
1887	C₄H₁₀S₂	1,4-Butanedithiol	budisl14
1888	C₄H₁₁NO	Diethylhydroxylamine	c3710847
1889	C₅H₁₂O	1-Butanol, 2-methyl-	c137326
1890	C₅H₁₂O	1-Butanol, 3-methyl-	c123513
1891	C₅H₁₂O	1-Pentanol	pentanol1
1892	C₅H₁₂O	2-Butanol, 3-methyl-	c598754
1893	C₅H₁₂O	2-Pentanol	peol2
1894	C₅H₁₂O	3-Pentanol	pentan3ol
1895	C₅H₁₂O	Butane, 1-methoxy-	meobu
1896	C₅H₁₂O	Propane, 1-ethoxy-	proet
1897	C₅H₁₂O	Propane, 2-methoxy-2-methyl-	c1634044
1898	C₅H₁₂S	1-Butanethiol, 2-methyl-	c1878188
1899	C₅H₁₂S	1-Butanethiol, 3-methyl-	c541311
1900	C₅H₁₂S	1-Pentanethiol	c110667
1901	C₅H₁₂S	1-Propanethiol, 2,2-dimethyl-	c1679089
1902	C₅H₁₂S	2-Butanethiol, 2-methyl-	c1679090
1903	C₅H₁₂S	2-Butanethiol, 3-methyl-	c2084186
1904	C₅H₁₂S	Butane, 1-(methylthio)-	c628295
1905	C₅H₁₂S	Ethyl propyl sulfide	c4110503
1906	C₅H₁₂S	Propane, 2-(ethylthio)-	c5145993
1907	C₅H₁₂S	Propane, 2-methyl-2-(methylthio)-	c6163640
1908	C₄F₂	difluorobutadiyne	c4f2
1909	ClCOClCO	Oxalyl chloride	oxcl
1910	CF₃CN	Acetonitrile, trifluoro-	cf3cn
1911	CF₃CN⁺	Acetonitrile, trifluoro- cation	cf3cn+
1912	B₂F₄	Diboron tetrafluoride	b2f4
1913	B₂Cl₄	Diboron tetrachloride	b2cl4
1914	C₂F₄	Tetrafluoroethylene	c2f4
1915	C₂F₄⁺	Tetrafluoroethylene cation	c2f4+
1916	C₂ClF₃	Ethene, chlorotrifluoro-	c2f3cl
1917	CF₂CCl₂	difluorodichloroethylene	cf2ccl2
1918	CFClCClF	trans-1,2-dichloro-1,2-difluoroethylene	cfclcclf
1919	CFClCFCl	cis-1,2-dichloro-1,2-difluoroethylene	cfclcfcl
1920	C₂FCl₃	fluorotrichloroethene	c2fcl3
1921	C₂Cl₄	Tetrachloroethylene	c2cl4
1922	C₂Br₄	tetrabromoethene	c2br4
1923	CF₃OF	Trifluoromethylhypofluorite	cf3of
1924	SOF₄	Sulfur tetrafluoride oxide	sof4
1925	PF₅	Phosphorus pentafluoride	pf5
1926	AsF₅	Arsenic pentafluoride	asf5
1927	PCl₅	Phosphorus pentachloride	pcl5
1928	SF₅	Sulfur pentafluoride	sf5
1929	SF₅⁺	pentafluoro sulfur cation	sf5+
1930	SbCl₅	Antimony pentachloride	sbcl5
1931	BrF₅	bromine pentafluoride	brf5
1932	ClF₅	chlorinepentafluoride	clf5
1933	IF₅	pentafluoroiodine	if5
1934	CF₃CHO	trifluoroacetaldehyde	cf3cho
1935	CCl₃CHO	trichloroacetaldehyde	ccl3cho
1936	CHFClCHClF	ethane, 1,2-dichloro-1,2-difluoro-	chfclchclf
1937	CF₃CH₂F	1,1,1,2-tetrafluoroethane	cf3ch2f
1938	CHF₂CHF₂	1,1,2,2-tetrafluoroethane	chf2chf2
1939	CF₃CH₂Cl	2,2,2-Trifluoroethyl chloride	cf3ch2cl
1940	CHFClCHFCl	1,2-dichloro-1,2-difluoroethane RR	chfclchfcl
1941	CH₂ClCCl₃	1,1,1,2-tetrachloroethane	ch2clccl3
1942	CHCl₂CHCl₂	Ethane, 1,1,2,2-tetrachloro-	chcl2chcl2
1943	CH₂BrCBr₃	1,1,1,2-tetrabromo ethane	c2h2br4
1944	CHCl₂CHF₂	1,1-dichloro-2,2-difluoroethane	c2h2cl2f2
1945	CF₃COOH	trifluoroacetic acid	cf3cooh
1946	C₄H₃ClO	Furan, 2-chloro	fur2cl
1947	C₄H₃ClO	Furan,3-chloro	fur3cl
1948	C₃H₅ClO₂	Carbonochloridic acid, ethyl ester	c541413
1949	C₃H₅Cl₃	Propane, 1,2,3-trichloro-	prcl135
1950	C₄H₈Cl₂	1,4-Dichlorobutane	c110565
1951	C₄H₈Cl₂	Butane, 1,2-dichloro-	c616217
1952	C₄H₈Cl₂	Butane, 1,3-dichloro-	c1190223
1953	C₄H₈Cl₂	Butane, 2,3-dichloro-, (r,r)-(.+/-.)-	c2211678
1954	C₄H₈Cl₂	Butane, 2,3-dichloro-, (r,s)-	c4028562
1955	C₄H₉ClO	1-Chloro-2-ethoxyethane	c628342
1956	C₅H₁₁Cl	Pentane, 1-chloro-	pencl1
1957	C₄H₈O₂	Butanoic acid	bua
1958	C₆H₅CH₂	benzyl radical	benzyl
1959	C₇H₇	cycloheptatrienyl radical	c7h7
1960	C₇H₇⁺	cycloheptatrienyl cation	c7h7+
1961	C₆H₅CH₃	toluene	toluene
1962	C₇H₈	cycloheptatriene	cht
1963	C₇H₈	Norbornadiene	norbor
1964	C₇H₈	Quadricyclane	qucy
1965	C₇H₁₂	Norbornane	nor
1966	C₇H₁₄	cycloheptane	c7h14
1967	C₇H₁₆	2-methylhexane	2mhex
1968	C₇H₁₆	3-methylhexane	hex3m
1969	C₇H₁₆	heptane	heptane
1970	CH(CN)₃	tricyanomethane	mecn3
1971	HN=C=C(CN)₂	Dicyanoketenimine	c4hn3
1972	C₆H₇N	2-Methylpyridine	mp
1973	C₆H₅NH₂	aniline	aniline
1974	C₆H₁₃N	2-Methylpiperidine	pip2m
1975	C₆H₁₃N	cyclohexanamine	cham
1976	C₆H₁₅N	triethylamine	tea
1977	N₂O₅	Dinitrogen pentoxide	n2o5
1978	C₄H₂O₃	Maleic Anhydride	malan
1979	C₅H₄O₂	4-Cyclopentene-1,3-dione	cpdio
1980	C₅H₄O₂	furfural	furfural
1981	C₆H₅O	phenoxy radical	phenoxy
1982	C₅H₅NO	2(1H)-Pyridinone	c72762006
1983	C₅H₅NO	2(3H)-Pyridinone	c9000048
1984	C₅H₅NO	2(5H)-Pyridinone	c9000037
1985	C₅H₅NO	2-Pyridinol	c109104
1986	C₅H₅NO	3(2H)-Pyridinone	c9000004
1987	C₅H₅NO	3(4H)-Pyridinone	c9000026
1988	C₅H₅NO	3(6H)-Pyridinone	c9000015
1989	C₅H₅NO	3-Pyridinol	c109002
1990	C₅H₅NO	4(1H)-Pryidinone	c9000060
1991	C₅H₅NO	4(3H)-Pryidinone	c9000059
1992	C₅H₅NO	4-Pyridinol	c626642
1993	C₆H₅OH	phenol	phenol
1994	C₆H₆O	2,4-Cyclohexadienone	c24599573
1995	C₆H₆O	2,5-Cyclohexadienone	c5664335
1996	C₆H₅SH	Benzenethiol	phsh
1997	HO₂CCHNH₂CH₂OH	Serine	serine
1998	C₅H₈O₂	Acetylacetone	acac
1999	C₄H₈O₂S	Sulfolane	sulfolane
2000	C₇H₁₀	Norbornene	norbornene
2001	CH(C₂H₃)₃	trivinyl methane	tvm
2002	C₆H₁₀O	cyclohexanone	chexo
2003	C₆H₁₂O	hexanal	c6h12o
2004	C₆H₁₂O	Oxepane	oxepane
2005	C₃H₇OC₃H₇	di-n-propyl ether	propr
2006	F₂CCCF₂	tetrafluoroallene	pfa
2007	CF₃COO^-	trifluoro acetate anion	cf3coo-
2008	CF₃COF	trifluoroacetyl fluoride	cf3cof
2009	CF₃COCl	trifluoroacetyl chloride	cf3cocl
2010	PF₆	Hexafluorophosphate neutral	pf6
2011	PF₆^-	Hexafluorophosphate ion	pf6-
2012	SF₆	Sulfur Hexafluoride	sf6
2013	SeF₆	Selenium hexafluoride	sef6
2014	SF₅Cl	sulfur chloropentafluoride	sf5cl
2015	CF₃CHF₂	pentafluoroethane	cf3chf2
2016	CF₃CHFCl	1,1,1,2-tetrafluorochloroethane	cf3chfcl
2017	CF₃CHCl₂	1,1-Dichloro-2,2,2-trifluoroethane	cf3chcl2
2018	CHCl₂CClF₂	Ethane, 1,2,2-trichloro-1,1-difluoro-	chcl2cclf2
2019	CCl₃CHCl₂	pentachloroethane	ccl3chcl2
2020	C₆H₅F	Fluorobenzene	bzf
2021	C₆H₅Cl	chlorobenzene	bzcl
2022	C₆H₅Br	bromobenzene	bzbr
2023	C₈H₆	Calicene	calicene
2024	C₆H₅CCH	phenylacetylene	phac
2025	C₈H₆	benzocyclobutadiene	bcbd
2026	C₈H₆	Pentalene	pentalene
2027	C₆H₅CHCH₂	Styrene	styrene
2028	C₈H₈	cubane	cubane
2029	C₈H₈	cyclooctatetraene	cot
2030	C₆H₅CH₂CH₃	Ethylbenzene	etbz
2031	CH₃C₆H₄CH₃	meta-xylene	mxylene
2032	CH₃C₆H₄CH₃	paraxylene	pxylene
2033	C₈H₁₄	Bicyclo[2.2.2]octane	bico222
2034	C₈H₁₆	cyclooctane	cyclooct
2035	(CH₃)₃CC(CH₃)₃	tetramethylbutane	tmb
2036	C₈H₁₈	Octane	c8h18
2037	C₆H₅CN	phenyl cyanide	phcn
2038	C₆H₁₂N₂	Triethylenediamine	ted
2039	C₄O₄^--	squarate dianion	c4o4--
2040	S₄N₄	Tetrasulfur tetranitride	s4n4
2041	S₈	Octasulfur	s8
2042	C₆H₄O₂	parabenzoquinone	pbq
2043	C₄H₄N₂O₂	Uracil	uracil
2044	C₆H₅CHO	benzaldehyde	benzal
2045	C₆H₅OCH₃	Anisole	anisole
2046	C₅H₉NO₂	Proline	proline
2047	C₆H₁₂O₂	Methyl pivalate	c598981
2048	C₆H₁₂O₂	Hexanoic acid	hexa
2049	C₄F₄	tetrafluorcyclobutadiene	c4f4
2050	Al₂Cl₆	Aluminum, di-μ-chlorotetrachlorodi-	al2cl6
2051	CF₃CF₂Cl	pentafluorochloroethane	cf3cf2cl
2052	CF₂ClCF₂Cl	1,2-Dichloro-1,1,2,2-tetrafluoroethane	cf2clcf2cl
2053	CF₃CFCl₂	1,1-Dichlorotetrafluoroethane	cf3cfcl2
2054	CF₂ClCFCl₂	Ethane, 1,1,2-trichloro-1,2,2-trifluoro-	cf2clcfcl2
2055	CF₃CCl₃	1,1,1-trifluoro-2,2,2-trichloroethane	cf3ccl3
2056	C₂F₆	hexafluoroethane	c2f6
2057	C₂Cl₆	hexachloroethane	c2cl6
2058	IF₇	Iodine heptafluoride	if7
2059	C₆H₄F₂	metadifluorobenzene	mdfb
2060	C₆H₄F₂	orthodifluorobenzene	odfb
2061	C₆H₄F₂	1,4-difluorobenzene	pdfb
2062	C₆H₄Cl₂	1,2-dichlorobenzene	dcb12
2063	C₆H₄Cl₂	1,3-dichlorobenzene	dcb13
2064	C₆H₄Cl₂	1,4-dichlorobenzene	dcb14
2065	C₆H₅NO	nitrosobenzene	bzno
2066	C₉H₈	Indene	indene
2067	C₉H₈	spiro[4.4]nona-1,3,6,8-tetraene	snt
2068	C₉H₁₂	n-propyl benzene	prbz
2069	C₉H₂₀	Nonane	nonane
2070	C(CN)₄	tetracyanomethane	c5n4
2071	C₅H₄N₄	purine	purine
2072	C₈H₇N	Indole	indole
2073	C₃H₃N₃O₃	cyanuric acid	cyanuric
2074	C₆H₅NO₂	Nitrobenzene	c6h5no2
2075	C₆H₅COOH	benzoic acid	benzo
2076	CH₃COC₆H₅	acetophenone	acph
2077	C₃Cl₃N₃	1,3,5-Triazine, 2,4,6-trichloro-	c3cl3n3
2078	C₃F₆	hexafluoropropene	c3f6
2079	C₆H₃F₃	Benzene trifluoride 123	bzf3a
2080	C₈H₁₈O	1-Octanol	octanol
2081	C₁₀H₈	Azulene	azu
2082	C₁₀H₈	naphthalene	naph
2083	C₁₀H₁₀	bullvalene	bullv
2084	C₁₀H₁₆	adamantane	adamantane
2085	C₆N₄	Tetracyanoethylene	tcne
2086	C₆N₄^-	tetracyanoethylene anion	tcne-
2087	C₁₀H₂₂	Decane	decane
2088	C₄F₆	perfluorobutadiene	c4f6
2089	SF₅CF₃	Sulfur, pentafluoro(trifluoromethyl)-	sf5cf3
2090	C₃F₈	perfluoropropane	c3f8
2091	Fe(CO)₅	Iron pentacarbonyl	ipc
2092	Fe(C₅H₅)₂	ferrocene	fecp2
2093	B₁₂H₁₂^--	Dodecahydrododecaborate(2-)	b12h12--
2094	B₁₂H₁₂^--	Dodecahydrododecaborate(2-)	b12h12--
2095	C₁₂H₈	Acenaphthylene	acenaph
2096	C₁₂H₈	biphenylene	biph
2097	C₁₂H₁₀	biphenyl	biphenyl
2098	C₁₂H₁₀	Heptalene	heptalene
2099	C₆H₁₂O₆	Inositol	inositol
2100	C₆F₆	hexafluorobenzene	c6f6
2101	S₂F₁₀	disulphur decafluoride	s2f10
2102	C₁₃H₁₀	Fluorene	fluorene
2103	C₁₄H₁₀	Anthracene	anth
2104	C₁₄H₁₀	Phenanthrene	phenanthrene
2105	C₁₄H₁₄	Bibenzyl	bibenzyl
2106	C₁₂H₁₀N₂	azobenzene	azobenzene
2107	C₆H₅COC₆H₅	benzophenone	benzophenone
2108	C₁₆H₁₀	Pyrene	pyrene
2109	C₁₈H₁₂	Tetracene	tetracene
2110	C₁₉H₁₆	Triphenylmethane	tpm
2111	C₂₄H₁₂	Coronene	coronene
2112	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