Species |
Name |
Bond Length (Å) |
Atom1 index |
Atom2 index |
CS- |
carbon monosulfide anion |
1.642 |
1 |
2 |
CS |
carbon monosulfide |
1.542 |
1 |
2 |
CS+ |
carbon monosulfide cation |
1.495 |
1 |
2 |
HCS- |
Thioformyl anion |
1.690 |
1 |
3 |
HCS+ |
Thioformyl cation |
1.480 |
1 |
3 |
H2CS- |
thioformaldehyde anion |
1.720 |
1 |
2 |
H2CS |
Thioformaldehyde |
1.614 |
1 |
2 |
H2CS+ |
thioformaldehyde cation |
1.597 |
1 |
2 |
H2CSH+ |
Thioformaldehyde, protonated |
1.625 |
1 |
2 |
CH3SH |
Methanethiol |
1.824 |
1 |
2 |
CH3SH+ |
Methanethiol cation |
1.782 |
1 |
2 |
CH3SH2+ |
protonated methylsulfide |
1.831 |
1 |
2 |
CS2- |
Carbon disulfide anion |
1.643 |
1 |
2 |
|
|
1.643 |
1 |
3 |
CS2 |
Carbon disulfide |
1.559 |
1 |
2 |
|
|
1.559 |
1 |
3 |
CS2+ |
Carbon disulfide cation |
1.559 |
1 |
2 |
|
|
1.559 |
1 |
3 |
OCS |
Carbonyl sulfide |
1.567 |
1 |
3 |
OCS+ |
Carbonyl sulfide cation |
1.635 |
1 |
3 |
SCN- |
thiocyanide anion |
1.664 |
1 |
2 |
SCN |
thiocyanato radical |
1.630 |
1 |
2 |
SCSe |
Carbon sulfide selenide |
1.557 |
1 |
2 |
HSCN |
thiocyanic acid |
1.698 |
1 |
2 |
HNCS |
Isothiocyanic acid |
1.574 |
2 |
3 |
CH2CS |
Thioketene |
1.563 |
2 |
3 |
CHSNH2 |
thioformamide |
1.643 |
1 |
2 |
NHCHSH |
Methanimidothioic acid |
1.760 |
2 |
3 |
C2H4S |
Thiirane |
1.820 |
1 |
2 |
|
|
1.820 |
1 |
3 |
CH2CHSH |
Ethenethiol |
1.761 |
2 |
3 |
CH3SSH |
Hydrogen methyl disulfide |
1.820 |
1 |
2 |
HSCH2SH |
Methanedithiol |
1.823 |
1 |
2 |
|
|
1.823 |
1 |
3 |
CH3CHS |
Thioacetaldehyde |
1.624 |
1 |
3 |
CH3CH2SH |
ethanethiol |
1.832 |
2 |
3 |
CH3SCH3 |
Dimethyl sulfide |
1.814 |
1 |
2 |
|
|
1.814 |
1 |
3 |
CH3SCH3+ |
dimethyl sulfide cation |
1.787 |
1 |
2 |
|
|
1.787 |
1 |
3 |
CS3-- |
Carbonotrithioate |
1.745 |
1 |
2 |
|
|
1.745 |
1 |
3 |
|
|
1.745 |
1 |
4 |
Cl2CS |
Thiophosgene |
1.607 |
1 |
2 |
NH2CSNH2 |
Thiourea |
1.669 |
1 |
2 |
CH3CSNH2 |
Ethanethioamide |
1.658 |
1 |
2 |
C3H6S |
Thietane |
1.850 |
1 |
2 |
|
|
1.850 |
1 |
3 |
CH2SHCH2SH |
1,2-Ethanedithiol |
1.837 |
1 |
4 |
|
|
1.837 |
2 |
3 |
CH3SSCH3 |
Disulfide, dimethyl |
1.823 |
1 |
3 |
|
|
1.823 |
2 |
4 |
C3H6S |
Thiirane, methyl- |
1.833 |
2 |
4 |
|
|
1.823 |
3 |
4 |
CH3CSCH3 |
Thioacetone |
1.635 |
1 |
2 |
CH3CHSHCH3 |
2-Propanethiol |
1.843 |
1 |
2 |
C3H7SH |
1-Propanethiol |
1.836 |
10 |
12 |
CH3SCH2CH3 |
Ethane, (methylthio)- |
1.825 |
5 |
8 |
|
|
1.815 |
8 |
9 |
C3H3NS |
Thiazole |
1.737 |
1 |
2 |
|
|
1.723 |
1 |
3 |
C4H4S |
Thiophene |
1.725 |
1 |
2 |
|
|
1.725 |
1 |
3 |
CH5N3S |
Hydrazinecarbothioamide |
1.672 |
3 |
4 |
CH3SO2NH2 |
methanesulfonamide |
1.788 |
1 |
2 |
C2H6O2S |
Dimethyl sulfone |
1.797 |
1 |
4 |
|
|
1.797 |
1 |
5 |
CH2CHSCHCH2 |
Divinyl sulfide |
1.762 |
1 |
2 |
|
|
1.761 |
1 |
3 |
C4H6S |
Thiophene, 2,3-dihydro- |
1.842 |
1 |
11 |
|
|
1.765 |
7 |
11 |
C4H6S |
Thiophene, 2,5-dihydro- |
1.838 |
1 |
2 |
|
|
1.838 |
1 |
3 |
CH3SSSCH3 |
dimethyl trisulfide |
1.820 |
2 |
4 |
|
|
1.820 |
3 |
5 |
C3H8S2 |
1,3-Propanedithiol |
1.835 |
2 |
6 |
|
|
1.835 |
3 |
7 |
C(CH3)3SH |
2-Propanethiol, 2-methyl- |
1.858 |
1 |
2 |
C4H9SH |
1-Butanethiol |
1.836 |
1 |
2 |
C2H5SC2H5 |
Diethyl sulfide |
1.825 |
1 |
2 |
|
|
1.825 |
1 |
3 |
CH2(SH)CH(CH3)CH3 |
1-Propanethiol, 2-methyl- |
1.839 |
5 |
11 |
CH3CH(SH)CH2CH3 |
2-Butanethiol |
1.845 |
1 |
6 |
CH3C(SCH3)HCH3 |
Propane, 2-(methylthio)- |
1.815 |
1 |
2 |
|
|
1.838 |
2 |
3 |
C2H4N2S2 |
Ethanedithioamide |
1.664 |
1 |
3 |
|
|
1.664 |
2 |
4 |
C3H6S3 |
1,3,5-Trithiane |
1.819 |
1 |
4 |
|
|
1.819 |
1 |
6 |
|
|
1.819 |
2 |
4 |
|
|
1.819 |
2 |
5 |
|
|
1.819 |
3 |
5 |
|
|
1.819 |
3 |
6 |
C4H6OS |
Vinyl sulfoxide |
1.803 |
1 |
3 |
|
|
1.803 |
1 |
4 |
C5H10S |
2H-Thiopyran, tetrahydro- |
1.824 |
1 |
5 |
|
|
1.824 |
1 |
6 |
SF5CF3 |
Sulfur, pentafluoro(trifluoromethyl)- |
1.933 |
1 |
2 |