I.B.1.d.6.

List of molecules with calculations for multiple conformations, states, and charged species

Multiple conformations

Species	Name	CAS Number	conformations
C₅H₁₀O	2-Pentanone	107879	2
CH₃OH^-	Methyl alcohol anion	67561	2
HOCO	Hydrocarboxyl radical	2564865	2
CH₂CHCH₂CH₂CH₃	1-pentene	109671	2
C₃H₆O₂	1,3-Dioxolane	646060	2
C₂H₅⁺	Ethyl cation	2025561	2
BH₃^-	boron trihydride anion	13283313	2
C₄H₆(CH₃)₂	dimethylcyclobutane	18931710	2
CH₂Cl	chloromethyl radical	6806866	2
CHONH₂	formamide	75127	2
CH₃OOCH₃	dimethylperoxide	690028	2
CH₄⁺	Methane cation	74828	2
C₄H₂⁺	diacetlyene cation	460128	2
C₂H₄N₂S₂	Ethanedithioamide	79403	2
ZnCH₂	Zinc methylene	115410770	2
AlH₃^-	aluminum trihydride anion	7784216	2
H₂CO₃	Carbonic acid	463796	2
CH₃CH₂CH₂CH₃	Butane	106978	2
CH₃CN⁺	Acetonitrile cation	75058	2
C₄H₄	cyclobutadiene	1120532	2
B₂Cl₄	Diboron tetrachloride	13701672	2
HOCH₂COOH	Hydroxyacetic acid	79141	2
NO₃⁺	nitrogen trioxide cation	12033497	2
CH₃COCH₃	Acetone	67641	2
O₃^-	Ozone anion	10028156	2
C₆H₁₂	cis-1,2-dimethylcyclobutane	15679013	2
C₃H₇NO	dimethylformamide	68122	2
C₂H₄O₂	1,3-dioxetane	61233190	2
CH₂CHOCHCH₂	Vinyl ether	109933	2
C₃H₅Cl₃	Propane, 1,2,3-trichloro-	96184	2
HCCO	ketenyl radical	51095159	2
C₃H₇NO	dimethylformamide	68122	3
H₂O₂⁺	Hydrogen peroxide cation	7722841	2
C₂H₄F₂	1,2-difluoroethane	624726	2
NF₃^-	Nitrogen trifluoride anion	7783542	2
C₁₄H₁₀	Anthracene	120127	2
C₃O₂	Carbon suboxide	504643	2
C₃⁺	carbon trimer cation	12075353	2
CH₄⁺	Methane cation	74828	3
CaH₂	Calcium Hydride	7789788	2
NH₃NH₃	Ammonia Dimer	22	2
BF₃^-	Borane, trifluoro- anion	7637072	2
HCN^-	Hydrogen cyanide anion	74908	2
CH₂ClCH₂CH₃	Propane, 1-chloro-	540545	2
(CH₃)₃CC(CH₃)₃	tetramethylbutane	594821	2
SF₂^-	sulfur difluoride anion	13814250	2
C₅H₁₀O	2-Butanone, 3-methyl-	563804	2
C₁₀H₈	Azulene	275514	2
HClO₃	Chloric Acid	7790934	2
C₂H⁺	Ethynyl cation	2122487	2
HCCCN⁺	Cyanoacetylene cation	1070719	2
CH₃C₆H₄CH₃	paraXylene	106423	2
CO₂^-	Carbon dioxide anion	124389	2
C₃H₈O₂	Methane, dimethoxy-	109875	2
C₂H₃⁺	vinyl cation	2669898	2
CH₂CH₂OH	2-hydroxy ethyl radical	4422542	2
BH₃⁺	boron trihydride cation	13283313	2
CF₂ClCFCl₂	Ethane, 1,1,2-trichloro-1,2,2-trifluoro-	76131	2
C₂O₄^-2	oxalate anion	9000208	2
SO₃^-	Sulfur trioxide anion	7446119	2
C₆H₁₂N₂	Triethylenediamine	280579	2
C₂H₄^-	Ethylene anion	74851	2
H₂O^-	water anion	7732185	2
NH₂CN	cyanamide	420042	2
C₄H₁₀O₂	1,4-Butanediol	110634	2
CaCO₃	Calcium Carbonate	471341	2
NO₃	Nitrogen trioxide	12033497	2
C₆H₁₂	2-Hexene, (E)-	4050457	3
C₆H₁₂	trans-1,3-dimethylcyclobutane	2398109	2
C₃H₈O₂	1,3-Propanediol	504632	2
C₃H₃^-	Propargyl anion	2932787	2
C₄H₈O₂	Ethyl acetate	141786	2
C₅H₁₀	Cyclopentane	287923	2
C₇H₁₆	3-methylhexane	589344	2
AlH₃⁺	aluminum trihydride cation	7784216	2
C₅H₄O₂	furfural	980101	2
Na₂O	disodium monoxide	1313593	2
CHOCH₂OH	hydroxy acetaldehyde	141468	2
C₅H₁₀O	3-Pentanone	96220	2
CH₂ClCHCHCH₃	2-Butene, 1-chloro-	591979	2
N₂O₅	Dinitrogen pentoxide	10102031	2
C₂H₃NO₃	Oxamic acid	471476	2
C₃O₂⁺	Carbon suboxide cation	504643	2
C₅H₁₁N	Piperidine	110894	2
ONNO	NO dimer	57932566	3
CH₃OO⁺	methylperoxy cation	2143580	2
ClF₅	chlorinepentafluoride	13637633	2
C₈H₁₄	Bicyclo[2.2.2]octane	280331	2
C₇H₇	cycloheptatrienyl radical	3551277	2
C₆H₆	2,4-Hexadiyne	2809690	2
C₆H₁₂	2-Hexene, (E)-	4050457	2
ZnCl₂	Zinc dichloride	7646857	2
C₆H₁₂	Cyclohexane	110827	2
Zn(CH₃)₂	dimethyl zinc	544978	2
CH₃COCH₂CH₃	2-Butanone	78933	2
C₄H₆O₂	2,3-Butanedione	431038	3
C₄H₆O₂	2,3-Butanedione	431038	2
C₆H₄O₂	parabenzoquinone	106514	2

Multiple states

Species	Name	CAS Number	states
B^-	Boron atom anion	7440428	2
SiF₂	Silicon difluoride	1396660	2
Li₂	Lithium diatomic	14452596	2
CH₂	Methylene	2465567	2
HCS^-	Thioformyl anion	36058283	2
B₂	Boron diatomic	14452610	2
SH⁺	sulfur monohydride cation	13940211	2
S₂	Sulfur diatomic	23550450	2
LiO⁺	lithium oxide cation	12142777	2
Al₂	Aluminum diatomic	32752946	2
NS^-	nitrogen sulfide anion	12033566	2
CH₃COCH₃	Acetone	67641	2
O₂	Oxygen diatomic	7782447	2
NH	Imidogen	13774920	2
CP⁺	carbon monophosphide cation	12326851	2
BeN⁺	Beryllium mononitride cation	37279111	2
Al^-	Aluminum atom anion	7429905	2
CH	Methylidyne	3315375	2
ZnS	Zinc sulfide	1314983	2
SCl⁺	sulfur monochloride cation	14989323	2
BC^-	boron monocarbide anion	12011540	2
C₂H⁺	Ethynyl cation	2122487	2
Ge₂	Germanium dimer	12596053	2
OH⁺	hydoxyl cation	3352576	2
C₂⁺	carbon diatomic cation	12070154	2
NF	nitrogen fluoride	13967061	2
Al₂	Aluminum diatomic	32752946	3
SO	Sulfur monoxide	13827322	2
Be₂	Beryllium diatomic	14452609	2
AlN	Aluminum nitride	24304005	2
NCl	nitrogen monochloride	12190759	2
AsF	Arsenic monofluoride	15120135	2
CCH₂	vinylidene	2143693	2
Si₂	Silicon diatomic	12597352	2
PCl	phosphorus chloride	17167554	2
C₂	Carbon diatomic	12070154	2
BO₂⁺	Boron dioxide cation	13840885	2
SF⁺	sulfur monofluoride cation	16068965	2
SeO	Selenium monoxide	12640890	2
PF	phosphorus monofluoride	16027922	2
ClO⁺	chlorine monoxide cation	14989301	2
NH₂⁺	Amino cation	13770406	2
ZnCH₂	Zinc methylene	115410770	2
HSe⁺	selenium monohydride cation	13940222	2
CCO	Dicarbon monoxide	12071237	2
CF₂	Difluoromethylene	2154598	2
SiP⁺	Silicon monophosphide cation	12137643	2
PH	phosphorus monohydride	13967141	2
B₂	Boron diatomic	14452610	3
BeN	Beryllium mononitride	37279111	2
SiH₂	silicon dihydride	13825906	2
BC⁺	boron monocarbide cation	12011540	2
PS^-	phosphorus monosulfide anion	12281366	2
LiO^-	lithium oxide anion	12142777	2
HCF	Fluoromethylene	13453526	2
NO^-	nitric oxide anion	10102439	2
Se₂	Selenium diatomic	12185170	2
CF^-	carbon monofluoride anion	3889756	2
LiN	Lithium Nitride	32746319	2
BN	boron nitride	10043115	2
SiC	silicon monocarbide	409212	2

Molecules with calculations for charged species

Species	Name	Charge	Neutral Name
Al^-	Aluminum atom anion	-1	Aluminum atom
Al⁺	Aluminum atom cation	+1	Aluminum atom
Al₂^-	aluminum dimer anion	-1	Aluminum diatomic
Al₂⁺	aluminum dimer cation	+1	Aluminum diatomic
AlCl^-	aluminum monochloride anion	-1	Aluminum monochloride
AlCl⁺	aluminum monochloride cation	+1	Aluminum monochloride
AlF^-	Aluminum monofluoride anion	-1	Aluminum monofluoride
AlF⁺	Aluminum monofluoride cation	+1	Aluminum monofluoride
AlH^-	aluminum monohydride anion	-1	aluminum monohydride
AlH⁺	aluminum monohydride cation	+1	aluminum monohydride
AlH₂^-	aluminum dihydride anion	-1	aluminum dihydride
AlH₂⁺	aluminum dihydride cation	+1	aluminum dihydride
AlH₃^-	aluminum trihydride anion	-1	aluminum trihydride
AlH₃⁺	aluminum trihydride cation	+1	aluminum trihydride
AlH₄^-	Aluminum tetrahydride anion	-1
AlN^-	aluminum mononitride anion	-1	Aluminum nitride
AlN⁺	aluminum mononitride cation	+1	Aluminum nitride
AlO^-	Aluminum monoxide anion	-1	Aluminum monoxide
AlO⁺	aluminum monoxide cation	+1	Aluminum monoxide
AlS^-	aluminum monosulfide anion	-1	Aluminum sulfide
AlS⁺	aluminum monosulfide cation	+1	Aluminum sulfide
Ar^-	Argon atom anion	-1	Argon atom
Ar⁺	Argon atom cation	+1	Argon atom
ArH⁺	Argon hydride cation	+1
As^-	Arsenic anion	-1	Arsenic atomic
As⁺	Arsenic cation	+1	Arsenic atomic
AsH₃⁺	Arsine cation	+1	Arsine
B^-	Boron atom anion	-1	Boron atom
B⁺	Boron atom cation	+1	Boron atom
B₂^-	Boron diatomic anion	-1	Boron diatomic
B₂⁺	Boron diatomic cation	+1	Boron diatomic
BC^-	boron monocarbide anion	-1	boron monocarbide
BC⁺	boron monocarbide cation	+1	boron monocarbide
BCl^-	boron monochloride anion	-1	boron monochloride
BCl⁺	boron monochloride cation	+1	boron monochloride
Be^-	Beryllium atom anion	-1	Beryllium atom
Be⁺	Beryllium atom cation	+1	Beryllium atom
Be₂^-	Beryllium dimer anion	-1	Beryllium diatomic
Be₂⁺	Beryllium diatomic cation	+1	Beryllium diatomic
BeCl^-	beryllium monochloride anion	-1	beryllium chloride
BeCl⁺	beryllium monochloride cation	+1	beryllium chloride
BeF^-	Beryllium monofluoride anion	-1	Beryllium monofluoride
BeF⁺	Beryllium monofluoride cation	+1	Beryllium monofluoride
BeH^-	berylium monohydride anion	-1	beryllium monohydride
BeH⁺	beryllium monohydride cation	+1	beryllium monohydride
BeN^-	Beryllium mononitride anion	-1	Beryllium mononitride
BeN⁺	Beryllium mononitride cation	+1	Beryllium mononitride
BeO^-	Beryllium monoxide anion	-1	beryllium oxide
BeO⁺	Beryllium monoxide cation	+1	beryllium oxide
BeS^-	Beryllium monosulfide anion	-1	beryllium sulfide
BeS⁺	Beryllium monosulfide cation	+1	beryllium sulfide
BF^-	Boron monofluoride anion	-1	Boron monofluoride
BF⁺	Boron monofluoride cation	+1	Boron monofluoride
BF₃^-	Borane, trifluoro- anion	-1	Borane, trifluoro-
BF₃⁺	boron trifluoride cation	+1	Borane, trifluoro-
BF₄^-	tetrafluoroboron anion	-1
BH^-	boron monohydride anion	-1	Boron monohydride
BH⁺	boron monohydride cation	+1	Boron monohydride
BH₃^-	boron trihydride anion	-1	boron trihydride
BH₃⁺	boron trihydride cation	+1	boron trihydride
BH₄^-	borohydride anion	-1
BN^-	boron nitride anion	-1	boron nitride
BN⁺	boron nitride cation	+1	boron nitride
BO^-	boron monoxide anion	-1	boron monoxide
BO⁺	boron monoxide cation	+1	boron monoxide
BO₂^-	Boron dioxide anion	-1	Boron dioxide
BO₂⁺	Boron dioxide cation	+1	Boron dioxide
Br^-	Bromine atom anion	-1	Bromine atom
Br⁺	Bromine atom cation	+1	Bromine atom
Br₂^-	bromine diatomic anion	-1	Bromine diatomic
Br₂⁺	bromine diatomic cation	+1	Bromine diatomic
BrCl^-	bromine chloride anion	-1	Bromine monochloride
BrCl⁺	bromine chloride cation	+1	Bromine monochloride
BrF^-	bromine fluoride anion	-1	Bromine monofluoride
BrF⁺	bromine fluoride cation	+1	Bromine monofluoride
BS^-	boron monosulfide anion	-1	boron sulfide
BS⁺	boron monosulfide cation	+1	boron sulfide
C^-	Carbon atom anion	-1	Carbon atom
C⁺	Carbon atom cation	+1	Carbon atom
C₂^-	carbon diatomic anion	-1	Carbon diatomic
C₂⁺	carbon diatomic cation	+1	Carbon diatomic
C₂Cl₂⁺	dichloroacetylene cation	+1	dichloroacetylene
C₂H^-	Ethynyl anion	-1	Ethynyl radical
C₂H⁺	Ethynyl cation	+1	Ethynyl radical
C₂H₂⁺	acetylene cation	+1	Acetylene
C₂H₂O₂⁺	Ethanedial cation	+1	Ethanedial
C₂H₃⁺	vinyl cation	+1	vinyl
C₂H₄^-	Ethylene anion	-1	Ethylene
C₂H₄⁺	Ethylene cation	+1	Ethylene
C₂H₅⁺	Ethyl cation	+1	Ethyl radical
C₂HF₃⁺	Trifluoroethylene cation	+1	Trifluoroethylene
C₂N₂⁺	Cyanogen cation	+1	Cyanogen
C₂O₄^-2	oxalate anion	-2
C₃⁺	carbon trimer cation	+1	carbon trimer
C₃H₃^-	Propargyl anion	-1	Propargyl radical
C₃H₃⁺	cyclopropenyl cation	+1
C₃H₃⁺	Propargyl cation	+1	Propargyl radical
C₃H₃N⁺	acrylonitrile cation	+1	acrylonitrile
C₃H₅⁺	Allyl cation	+1	Allyl radical
C₃O₂⁺	Carbon suboxide cation	+1	Carbon suboxide
C₄⁺	Carbon tetramer cation	+1	Carbon tetramer
C₄H₂⁺	diacetlyene cation	+1	Diacetylene
C₅H₅^-	cylopentadienyl anion	-1
C₇H₇⁺	cycloheptatrienyl cation	+1	cycloheptatrienyl radical
Ca^-	Calcium atom anion	-1	Calcium atom
Ca⁺	Calcium atom cation	+1	Calcium atom
CCl^-	carbon monochloride anion	-1	carbon monochloride
CCl⁺	carbon monochloride cation	+1	carbon monochloride
CCl₂^-	dichloromethylene anion	-1	dichloromethylene
CCl₂⁺	dichloromethylene cation	+1	dichloromethylene
CCl₃^-	Trichloromethyl anion	-1	Trichloromethyl radical
CCl₃⁺	Trichloromethyl cation	+1	Trichloromethyl radical
CF^-	carbon monofluoride anion	-1	Fluoromethylidyne
CF⁺	carbon monofluoride cation	+1	Fluoromethylidyne
CF₂^-	Difluoromethylene anion	-1	Difluoromethylene
CF₂⁺	Difluoromethylene cation	+1	Difluoromethylene
CF₃^-	Trifluoromethyl anion	-1	Trifluoromethyl radical
CF₃⁺	Trifluoromethyl cation	+1	Trifluoromethyl radical
CH^-	methylidyne anion	-1	Methylidyne
CH⁺	Methylidyne cation	+1	Methylidyne
CH₂^-	methylene anion	-1	Methylene
CH₂⁺	methylene cation	+1	Methylene
CH₂CHF⁺	fluoroethene cation	+1	Ethene, fluoro-
CH₂CO⁺	Ketene cation	+1	Ketene
CH₂NH₂⁺	methyleneamine cation	+1
CH₂OH⁺	hydroxymethyl cation	+1	Hydroxymethyl radical
CH₃^-	methyl anion	-1	Methyl radical
CH₃⁺	methyl cation	+1	Methyl radical
CH₃CN^-	acetonitrile anion	-1	Acetonitrile
CH₃CN⁺	Acetonitrile cation	+1	Acetonitrile
CH₃CO^-	Acetyl anion	-1	Acetyl radical
CH₃CO⁺	acetyl cation	+1	Acetyl radical
CH₃COO^-	acetate anion	-1
CH₃NH₃⁺	protonated methylamine	+1
CH₃O^-	methoxy anion	-1	Methoxy radical
CH₃OH^-	Methyl alcohol anion	-1	Methyl alcohol
CH₃OH⁺	Methyl alcohol cation	+1	Methyl alcohol
CH₃OO^-	methylperoxy anion	-1	methylperoxy radical
CH₃OO⁺	methylperoxy cation	+1	methylperoxy radical
CH₄⁺	Methane cation	+1	Methane
Cl^-	Chlorine atom anion	-1	Chlorine atom
Cl⁺	Chlorine atom cation	+1	Chlorine atom
Cl₂^-	chlorine diatomic anion	-1	Chlorine diatomic
Cl₂⁺	chlorine diatomic cation	+1	Chlorine diatomic
ClF^-	clorine monofluoride anion	-1	Chlorine monofluoride
ClF⁺	clorine monofluoride cation	+1	Chlorine monofluoride
ClO^-	chlorine monoxide anion	-1	Monochlorine monoxide
ClO⁺	chlorine monoxide cation	+1	Monochlorine monoxide
ClO₃^-	chlorate anion	-1
ClO₄^-	perchlorate anion	-1
ClOO⁺	chloroperoxy cation	+1	chloroperoxy radical
CN^-	cyanide anion	-1	Cyano radical
CN⁺	Cyano cation	+1	Cyano radical
CNH₂⁺	CNH2+	+1
CNO^-	fulminate	-1
CO^-	carbon monoxide anion	-1	Carbon monoxide
CO⁺	carbon monoxide cation	+1	Carbon monoxide
CO₂^-	Carbon dioxide anion	-1	Carbon dioxide
CO₂⁺	Carbon dioxide cation	+1	Carbon dioxide
CO₃^-2	carbonate	-2
CP^-	carbon monophosphide anion	-1	Carbon monophosphide
CP⁺	carbon monophosphide cation	+1	Carbon monophosphide
CS^-	carbon monosulfide anion	-1	carbon monosulfide
CS⁺	carbon monosulfide cation	+1	carbon monosulfide
CS₂⁺	Carbon disulfide cation	+1	Carbon disulfide
CSe^-	Carbon monoselenide anion	-1	Carbon monoselenide
CSe⁺	Carbon monoselenide cation	+1	Carbon monoselenide
Cu^-	Copper atom anion	-1	Copper atom
Cu⁺	Copper atom cation	+1	Copper atom
D^-	Deuterium atom anion	-1	Deuterium atom
D⁺	Deuterium atom cation	+1	Deuterium atom
F^-	Fluorine atom anion	-1	Fluorine atom
F⁺	Fluorine atom cation	+1	Fluorine atom
F₂^-	flourine diatomic anion	-1	Fluorine diatomic
F₂⁺	flourine diatomic cation	+1	Fluorine diatomic
FHF^-	FHF-	-1	FHF
FO^-	flourine oxide anion	-1	Oxygen monofluoride
FO⁺	fluorine monoxide cation	+1	Oxygen monofluoride
H^-	Hydrogen atom anion	-1	Hydrogen atom
H⁺	Hydrogen atom cation	+1	Hydrogen atom
H₂^-	hydrogen diatomic anion	-1	Hydrogen diatomic
H₂⁺	Hydrogen cation	+1	Hydrogen diatomic
H₂Cl⁺	dihydrogen monochloride cation	+1
H₂CN⁺	H2CN+	+1
H₂CO^-	formaldehyde anion	-1	Formaldehyde
H₂CO⁺	formaldehyde cation	+1	Formaldehyde
H₂F⁺	dihydrogen fluoride cation	+1
H₂O^-	water anion	-1	Water
H₂O⁺	water cation	+1	Water
H₂O₂⁺	Hydrogen peroxide cation	+1	Hydrogen peroxide
H₂S^-	Hydrogen sulfide anion	-1	Hydrogen sulfide
H₂S⁺	Hydrogen sulfide cation	+1	Hydrogen sulfide
H₂Se⁺	Hydrogen selenide cation	+1	Hydrogen selenide
H₃⁺	hydrogen trimer cation	+1
H₃O⁺	hydronium	+1
H₃O₂⁺	hydrogen peroxide, protonated	+1
H₃S⁺	H3S+	+1
HBr^-	hydrogen bromide anion	-1	hydrogen bromide
HBr⁺	hydrogen bromide cation	+1	hydrogen bromide
HCCCN⁺	Cyanoacetylene cation	+1	Cyanoacetylene
HCCF⁺	fluoroacetylene cation	+1	Fluoroacetylene
HCl^-	hydrogen chloride anion	-1	Hydrogen chloride
HCl⁺	hydrogen chloride cation	+1	Hydrogen chloride
HCN^-	Hydrogen cyanide anion	-1	Hydrogen cyanide
HCN⁺	hydrogen cyanide cation	+1	Hydrogen cyanide
HCNH⁺	HCNH+	+1
HCO^-	formyl anion	-1	Formyl radical
HCO⁺	Formyl cation	+1	Formyl radical
HCO₂^-	formate anion	-1
HCO₃^-	bicarbonate anion	-1
HCS^-	Thioformyl anion	-1	Thioformyl radical
HCS⁺	Thioformyl cation	+1	Thioformyl radical
He^-	Helium atom anion	-1	Helium atom
He⁺	Helium atom cation	+1	Helium atom
He₂⁺	helium dimer cation	+1
HeH⁺	Helium hydride cation	+1	Helium hydride
HF^-	hydrogen fluoride anion	-1	Hydrogen fluoride
HF⁺	hydrogen fluoride cation	+1	Hydrogen fluoride
HNO^-	Nitrosyl hydride anion	-1	Nitrosyl hydride
HNO⁺	Nitrosyl hydride cation	+1	Nitrosyl hydride
HNO₂⁺	nitrous acid cation	+1	Nitrous acid
HNS^-	HNS-	-1	HNS
HO₂^-	Hydroperoxy anion	-1	Hydroperoxy radical
HO₂⁺	Hydroperoxy cation	+1	Hydroperoxy radical
HOCO⁺	Hydrocarboxyl cation	+1	Hydrocarboxyl radical
HPO⁺	HPO cation	+1	HPO
HSe^-	selenium monohydride anion	-1	Selenium monohydride
HSe⁺	selenium monohydride cation	+1	Selenium monohydride
HSO₄^-	bisulfate anion	-1
I^-	Iodine atom anion	-1	Iodine atom
I⁺	Iodine atom cation	+1	Iodine atom
K^-	Potassium atom anion	-1	Potassium atom
K⁺	Potassium atom cation	+1	Potassium atom
Li^-	Lithium atom anion	-1	Lithium atom
Li⁺	Lithium atom cation	+1	Lithium atom
Li₂^-	lithium dimer anion	-1	Lithium diatomic
Li₂⁺	lithium diatomic cation	+1	Lithium diatomic
Li₂O⁺	dilithium oxide cation	+1	dilithium oxide
LiBr^-	lithium bromide cation	-1	Lithium Bromide
LiBr⁺	lithium bromide anion	+1	Lithium Bromide
LiCl^-	lithium chloride anion	-1	lithium chloride
LiCl⁺	lithium chloride cation	+1	lithium chloride
LiF^-	lithium fluoride anion	-1	lithium fluoride
LiF⁺	lithium fluoride cation	+1	lithium fluoride
LiH^-	lithium hydride anion	-1	Lithium Hydride
LiH⁺	lithium hydride cation	+1	Lithium Hydride
LiN⁺	Lithium Nitride cation	+1	Lithium Nitride
LiO^-	lithium oxide anion	-1	lithium oxide
LiO⁺	lithium oxide cation	+1	lithium oxide
Mg^-	Magnesium atom anion	-1	Magnesium atom
Mg⁺	Magnesium atom cation	+1	Magnesium atom
Mg₂^-	magnesium dimer anion	-1	Magnesium diatomic
Mg₂⁺	magnesium dimer cation	+1	Magnesium diatomic
MgCl^-	magnesium monochloride anion	-1	magnesium monochloride
MgCl⁺	magnesium monochloride cation	+1	magnesium monochloride
MgF^-	magnesium fluoride anion	-1	Magnesium monofluoride
MgF⁺	magnesium fluoride cation	+1	Magnesium monofluoride
MgH^-	magnesium monohydride anion	-1	magnesium monohydride
MgH⁺	magnesium monohydride cation	+1	magnesium monohydride
MgO^-	magnesium oxide anion	-1	magnesium oxide
MgO⁺	magnesium oxide cation	+1	magnesium oxide
MgS^-	magnesium sulfide anion	-1	magnesium sulfide
MgS⁺	magnesium sulfide cation	+1	magnesium sulfide
N^-	Nitrogen atom anion	-1	Nitrogen atom
N⁺	Nitrogen atom cation	+1	Nitrogen atom
N₂^-	nitrogen diatomic anion	-1	Nitrogen diatomic
N₂⁺	diatomic nitrogen cation	+1	Nitrogen diatomic
N₂O^-	Nitrous oxide anion	-1	Nitrous oxide
N₂O⁺	Nitrous oxide cation	+1	Nitrous oxide
N₃^-	azide anion	-1	azide radical
Na^-	Sodium atom anion	-1	Sodium atom
Na⁺	Sodium atom cation	+1	Sodium atom
Na₂^-	sodium dimer anion	-1	Sodium diatomic
Na₂⁺	sodium dimer cation	+1	Sodium diatomic
NaBr^-	sodium bromide anion	-1	Sodium Bromide
NaBr⁺	sodium bromide cation	+1	Sodium Bromide
NaCl^-	sodium chloride anion	-1	Sodium Chloride
NaCl⁺	sodium chloride cation	+1	Sodium Chloride
NaF^-	sodium fluoride anion	-1	sodium fluoride
NaF⁺	sodium fluoride cation	+1	sodium fluoride
NaH^-	sodium hydride anion	-1	sodium hydride
NaH⁺	sodium hydride cation	+1	sodium hydride
NaLi^-	lithium sodium anion	-1	lithium sodium
NaLi⁺	lithium sodium cation	+1	lithium sodium
NaO^-	sodium oxide anion	-1	sodium monoxide
NaO⁺	sodium oxide cation	+1	sodium monoxide
NCl^-	nitrogen monochloride anion	-1	nitrogen monochloride
NCl⁺	nitrogen monochloride cation	+1	nitrogen monochloride
NCO^-	cyanate	-1	isocyanato radical
Ne^-	Neon atom anion	-1	Neon atom
Ne⁺	Neon atom cation	+1	Neon atom
NeH⁺	neon hydrogen cation	+1	neon hydrogen
NF^-	nitrogen monofluorine anion	-1	nitrogen fluoride
NF⁺	nitrogen monofluoirde cation	+1	nitrogen fluoride
NF₂⁺	Difluoroamino cation	+1	Difluoroamino radical
NF₃^-	Nitrogen trifluoride anion	-1	Nitrogen trifluoride
NF₃⁺	Nitrogen trifluoride cation	+1	Nitrogen trifluoride
NH^-	Imidogen anion	-1	Imidogen
NH⁺	imidogen cation	+1	Imidogen
NH₂^-	amino anion	-1	Amino radical
NH₂⁺	Amino cation	+1	Amino radical
NH₂CONH₂⁺	Urea cation	+1	Urea
NH₃⁺	ammonia cation	+1	Ammonia
NH₄⁺	ammonium cation	+1
NNH⁺	Dinitrogen monohydride cation	+1	Dinitrogen monohydride
NO^-	nitric oxide anion	-1	Nitric oxide
NO⁺	nitric oxide cation	+1	Nitric oxide
NO₂^-	Nitrogen dioxide anion	-1	Nitrogen dioxide
NO₂⁺	Nitrogen dioxide cation	+1	Nitrogen dioxide
NO₃^-	nitrate anion	-1	Nitrogen trioxide
NO₃⁺	nitrogen trioxide cation	+1	Nitrogen trioxide
NS^-	nitrogen sulfide anion	-1	Mononitrogen monosulfide
NS⁺	nitrogen sulfide cation	+1	Mononitrogen monosulfide
O^-	Oxygen atom anion	-1	Oxygen atom
O⁺	Oxygen atom cation	+1	Oxygen atom
O₂^-	oxygen diatomic anion	-1	Oxygen diatomic
O₂⁺	diatomic oxygen cation	+1	Oxygen diatomic
O₃^-	Ozone anion	-1	Ozone
O₃⁺	Ozone cation	+1	Ozone
OClO^-	Chlorine dioxide anion	-1	Chlorine dioxide
OClO⁺	Chlorine dioxide cation	+1	Chlorine dioxide
OCS⁺	Carbonyl sulfide cation	+1	Carbonyl sulfide
OH^-	hydroxide anion	-1	Hydroxyl radical
OH⁺	hydoxyl cation	+1	Hydroxyl radical
P^-	Phosphorus atom anion	-1	Phosphorus atom
P⁺	Phosphorus atom cation	+1	Phosphorus atom
P₂^-	phosphorus dimer anion	-1	Phosphorus diatomic
P₂⁺	phosphorus dimer cation	+1	Phosphorus diatomic
PCl^-	phosphorus monochloride anion	-1	phosphorus chloride
PCl⁺	phosphorus monochloride cation	+1	phosphorus chloride
PF^-	phosphorus monofluoride anion	-1	phosphorus monofluoride
PF⁺	phosphorus monofluoride cation	+1	phosphorus monofluoride
PH^-	phosphorus monohydride anion	-1	phosphorus monohydride
PH⁺	phosphorus monohydride cation	+1	phosphorus monohydride
PH₂^-	Phosphino anion	-1	Phosphino radical
PH₂⁺	Phosphino cation	+1	Phosphino radical
PH₃⁺	Phosphine cation	+1	Phosphine
PH₄⁺	phosphonium cation	+1
PN^-	phosphorus nitride anion	-1	Phosphorus mononitride
PN⁺	phosphorus nitride cation	+1	Phosphorus mononitride
PO^-	phosphorus monoxide anion	-1	Phosphorus monoxide
PO⁺	phosphorus monoxide cation	+1	Phosphorus monoxide
PO₂^-	Phosphorus dioxide anion	-1	Phosphorus dioxide
PO₂⁺	Phosphorus dioxide cation	+1	Phosphorus dioxide
PO₄^-3	phosphate	-3
PS^-	phosphorus monosulfide anion	-1	phosphorus sulfide
PS⁺	phosphorus monosulfide cation	+1	phosphorus sulfide
S^-	Sulfur atom anion	-1	Sulfur atom
S⁺	Sulfur atom cation	+1	Sulfur atom
S₂^-	sulfur dimer anion	-1	Sulfur diatomic
S₂⁺	sulfur dimer cation	+1	Sulfur diatomic
S₃^-	Sulfur trimer anion	-1	Sulfur trimer
SCl^-	sulfur monochloride anion	-1	sulfur monochloride
SCl⁺	sulfur monochloride cation	+1	sulfur monochloride
SCN^-	thiocyanide anion	-1	thiocyanato radical
Se^-	Selenium atom anion	-1	Selenium atom
Se⁺	Selenium atom cation	+1	Selenium atom
Se₂^-	selenium dimer anion	-1	Selenium diatomic
Se₂⁺	selenium dimer cation	+1	Selenium diatomic
SeO^-	selenium monoxide anion	-1	Selenium monoxide
SeO⁺	selenium monoxide cation	+1	Selenium monoxide
SeS^-	selenium monosulfide anion	-1	Selenium monosulfide
SeS⁺	selenium monosulfide cation	+1	Selenium monosulfide
SF^-	sulfur monofluoride anion	-1	Monosulfur monofluoride
SF⁺	sulfur monofluoride cation	+1	Monosulfur monofluoride
SF₂^-	sulfur difluoride anion	-1	sulfur difluoride
SF₂⁺	sulfur difluoride cation	+1	sulfur difluoride
SH^-	mercapto anion	-1	Mercapto radical
SH⁺	sulfur monohydride cation	+1	Mercapto radical
Si^-	Silicon atom anion	-1	Silicon atom
Si⁺	Silicon atom cation	+1	Silicon atom
Si₂^-	silcon dimer anion	-1	Silicon diatomic
Si₂⁺	silcon dimer cation	+1	Silicon diatomic
SiC^-	silicon monocarbide anion	-1	silicon monocarbide
SiC⁺	silicon monocarbide cation	+1	silicon monocarbide
SiCl^-	silicon monochloride anion	-1	Clorosilylidyne
SiCl⁺	silicon monochloride cation	+1	Clorosilylidyne
SiCl₃⁺	trichlorosilyl cation	+1	trichlorosilyl radical
SiF^-	silicon monofluoride anion	-1	silicon monofluoride
SiF⁺	silicon monofluoride cation	+1	silicon monofluoride
SiH^-	silicon monohydride anion	-1	Silylidyne
SiH⁺	silicon monohydride cation	+1	Silylidyne
SiH₂^-	silicon dihydride anion	-1	silicon dihydride
SiH₂⁺	silicon dihydride cation	+1	silicon dihydride
SiH₃^-	silyl anion	-1	silyl
SiH₃⁺	silyl cation	+1	silyl
SiH₄⁺	Silane cation	+1	Silane
SiN^-	silicon mononitride anion	-1	Silicon nitride
SiN⁺	silicon mononitride cation	+1	Silicon nitride
SiO^-	silicon monoxide anion	-1	Silicon monoxide
SiO⁺	silicon monoxide cation	+1	Silicon monoxide
SiP^-	Silicon monophosphide anion	-1	Silicon monophosphide
SiP⁺	Silicon monophosphide cation	+1	Silicon monophosphide
SiS^-	silicon monosulfide anion	-1	silicon monosulfide
SiS⁺	silicon monosulfide cation	+1	silicon monosulfide
SO^-	sulfur monoxide anion	-1	Sulfur monoxide
SO⁺	sulfur monoxide cation	+1	Sulfur monoxide
SO₂^-	Sulfur dioxide anion	-1	Sulfur dioxide
SO₂⁺	Sulfur dioxide cation	+1	Sulfur dioxide
SO₃^-	Sulfur trioxide anion	-1	Sulfur trioxide
SO₃⁺	Sulfur trioxide cation	+1	Sulfur trioxide
SO₄^-2	sulfate	-2
Ti^-	Titanium atom anion	-1	Titanium atom
Ti⁺	Titanium atom cation	+1	Titanium atom
Zn^-	Zinc atom anion	-1	Zinc atom
Zn⁺	Zinc atom cation	+1	Zinc atom
ZnF^-	Zinc monofluoride anion	-1	Zinc monofluoride
ZnF⁺	Zinc monofluoride cation	+1	Zinc monofluoride