Species |
Name |
Bond Length (Å) |
Atom1 index |
Atom2 index |
CS- |
carbon monosulfide anion |
1.637 |
1 |
2 |
CS |
carbon monosulfide |
1.539 |
1 |
2 |
CS+ |
carbon monosulfide cation |
1.496 |
1 |
2 |
HCS- |
Thioformyl anion |
1.688 |
1 |
3 |
HCS |
Thioformyl radical |
1.564 |
1 |
3 |
HCS+ |
Thioformyl cation |
1.482 |
1 |
3 |
H2CS |
Thioformaldehyde |
1.610 |
1 |
2 |
CH3S |
thiomethoxy |
1.776 |
1 |
2 |
CH3SH |
Methanethiol |
1.810 |
1 |
2 |
CH3SH+ |
Methanethiol cation |
1.750 |
1 |
2 |
CS2- |
Carbon disulfide anion |
1.641 |
1 |
2 |
|
|
1.641 |
1 |
3 |
CS2 |
Carbon disulfide |
1.557 |
1 |
2 |
|
|
1.557 |
1 |
3 |
CS2+ |
Carbon disulfide cation |
1.557 |
1 |
2 |
|
|
1.557 |
1 |
3 |
OCS |
Carbonyl sulfide |
1.561 |
1 |
3 |
OCS+ |
Carbonyl sulfide cation |
1.616 |
1 |
3 |
SCN |
thiocyanato radical |
1.619 |
1 |
2 |
C2H4S |
Thiirane |
1.814 |
1 |
2 |
|
|
1.814 |
1 |
3 |
CH3CHS |
Thioacetaldehyde |
1.621 |
1 |
3 |
CH3CH2SH |
ethanethiol |
1.818 |
2 |
3 |
CH3SCH3 |
Dimethyl sulfide |
1.798 |
1 |
2 |
|
|
1.798 |
1 |
3 |
NH2CSNH2 |
Thiourea |
1.665 |
1 |
2 |
C3H6S |
Thietane |
1.844 |
1 |
2 |
|
|
1.844 |
1 |
3 |
CH2SHCH2SH |
1,2-Ethanedithiol |
1.664 |
1 |
4 |
|
|
1.664 |
2 |
3 |
CH3SSCH3 |
Disulfide, dimethyl |
1.808 |
1 |
3 |
|
|
1.808 |
2 |
4 |
C3H6S |
Thiirane, methyl- |
1.827 |
2 |
4 |
|
|
1.816 |
3 |
4 |
CH3CHSHCH3 |
2-Propanethiol |
1.732 |
1 |
2 |
C3H7SH |
1-Propanethiol |
1.747 |
10 |
12 |
CH3SCH2CH3 |
Ethane, (methylthio)- |
1.809 |
5 |
8 |
|
|
1.799 |
8 |
9 |
C4H4S |
Thiophene |
1.716 |
1 |
2 |
|
|
1.716 |
1 |
3 |
CH5N3S |
Hydrazinecarbothioamide |
1.678 |
3 |
4 |
C2H6O2S |
Dimethyl sulfone |
1.786 |
1 |
4 |
|
|
1.786 |
1 |
5 |
CH2CHSCHCH2 |
Divinyl sulfide |
1.745 |
1 |
2 |
|
|
1.745 |
1 |
3 |
C4H6S |
Thiophene, 2,3-dihydro- |
1.827 |
1 |
11 |
|
|
1.747 |
7 |
11 |
C4H6S |
Thiophene, 2,5-dihydro- |
1.828 |
1 |
2 |
|
|
1.828 |
1 |
3 |
CH3SSSCH3 |
dimethyl trisulfide |
1.803 |
2 |
4 |
|
|
1.803 |
3 |
5 |
C3H8S2 |
1,3-Propanedithiol |
1.819 |
2 |
6 |
|
|
1.819 |
3 |
7 |
C4H8S |
Thiophene, tetrahydro- |
2.149 |
3 |
13 |
|
|
1.781 |
12 |
13 |
C(CH3)3SH |
2-Propanethiol, 2-methyl- |
1.843 |
1 |
2 |
C2H5SC2H5 |
Diethyl sulfide |
1.810 |
1 |
2 |
|
|
1.810 |
1 |
3 |
CH2(SH)CH(CH3)CH3 |
1-Propanethiol, 2-methyl- |
1.514 |
5 |
11 |
CH3CH(SH)CH2CH3 |
2-Butanethiol |
1.514 |
1 |
6 |
CH3C(SCH3)HCH3 |
Propane, 2-(methylthio)- |
1.799 |
1 |
2 |
|
|
1.822 |
2 |
3 |
C2H4N2S2 |
Ethanedithioamide |
1.662 |
1 |
3 |
|
|
1.662 |
2 |
4 |
C3H4S3 |
1,3-Dithiolane-2-thione |
1.725 |
4 |
5 |
|
|
1.725 |
4 |
6 |
|
|
1.819 |
5 |
8 |
|
|
1.818 |
6 |
10 |
|
|
1.662 |
3 |
4 |
C3H4O2S |
2H-Thiete-1,1-dioxide |
1.711 |
1 |
4 |
|
|
1.834 |
1 |
8 |
C4H5NS |
4-Methylthiazole |
1.727 |
3 |
8 |
|
|
1.705 |
8 |
11 |
C3H6S3 |
1,3,5-Trithiane |
1.806 |
1 |
4 |
|
|
1.806 |
1 |
6 |
|
|
1.806 |
2 |
4 |
|
|
1.806 |
2 |
5 |
|
|
1.806 |
3 |
5 |
|
|
1.806 |
3 |
6 |
C5H6S |
Thiophene, 2-methyl- |
1.735 |
5 |
8 |
|
|
1.725 |
7 |
8 |
C5H6S |
Thiophene, 3-methyl- |
1.723 |
4 |
7 |
|
|
1.722 |
6 |
7 |
C4H6OS |
Dihydro-3-(2H)-thiophenone |
1.814 |
5 |
9 |
|
|
1.829 |
8 |
9 |
C4H6OS |
Dihydro-2-(3H)-thiophenone |
1.822 |
7 |
12 |
|
|
1.757 |
10 |
12 |
C4H6OS |
Vinyl sulfoxide |
1.814 |
1 |
3 |
|
|
1.814 |
1 |
4 |
CH6N4S |
Carbonothioic dihydrazide |
1.657 |
1 |
2 |
C3H6S3 |
Carbonotrithioic acid, dimethyl ester |
1.673 |
1 |
2 |
|
|
1.721 |
1 |
3 |
|
|
1.794 |
1 |
4 |
|
|
1.850 |
3 |
5 |
|
|
1.772 |
4 |
6 |
C4H6OS |
4,5-dihydrothiophene-3-ol |
1.761 |
1 |
2 |
|
|
1.830 |
1 |
5 |
C4H6OS |
2,5-dihydrothiophene-3-ol |
1.815 |
1 |
2 |
|
|
1.824 |
1 |
5 |
C4H6OS |
4,5-dihydrothiophene-2-ol |
1.765 |
1 |
2 |
|
|
1.825 |
1 |
5 |
C4H6OS |
2,3-dihydrothiophene-2-ol |
1.864 |
1 |
2 |
|
|
1.757 |
1 |
5 |
C3H8O2S |
(Methylsulfonyl)ethane |
1.790 |
5 |
12 |
|
|
1.783 |
8 |
12 |
C4H8OS |
s-Ethyl thioacetate |
1.426 |
2 |
3 |
|
|
1.523 |
3 |
10 |
C4H10OS |
Diethyl sulfoxide |
1.806 |
9 |
14 |
|
|
1.807 |
12 |
14 |
C4H10S2 |
1,4-Butanedithiol |
1.490 |
1 |
3 |
|
|
1.490 |
2 |
4 |
C5H10S |
2H-Thiopyran, tetrahydro- |
1.810 |
1 |
5 |
|
|
1.810 |
1 |
6 |
C5H10S |
Cyclopentanethiol |
1.518 |
14 |
16 |
C5H10S |
Thiophene, tetrahydro-2-methyl- |
1.830 |
5 |
6 |
|
|
1.815 |
5 |
9 |
C5H10S |
Thiophene, tetrahydro-3-methyl- |
1.820 |
1 |
6 |
|
|
1.815 |
1 |
11 |
C5H10S |
3-Ethylthio-1-propene |
1.810 |
8 |
9 |
|
|
1.809 |
9 |
12 |
C5H12S |
1-Pentanethiol |
1.701 |
1 |
3 |
C5H12S |
1-Butanethiol, 3-methyl- |
1.837 |
3 |
5 |
C5H12S |
Butane, 1-(methylthio)- |
1.525 |
3 |
4 |
|
|
1.524 |
4 |
5 |
C5H12S |
1-Propanethiol, 2,2-dimethyl- |
1.823 |
4 |
6 |
C5H12S |
1-Butanethiol, 2-methyl- |
1.512 |
5 |
7 |
C5H12S |
2-Butanethiol, 3-methyl- |
1.512 |
9 |
11 |
C5H12S |
Ethyl propyl sulfide |
1.526 |
5 |
8 |
|
|
1.520 |
8 |
9 |
C5H12S |
Propane, 2-(ethylthio)- |
1.812 |
2 |
5 |
|
|
1.844 |
5 |
6 |
C5H12S |
Propane, 2-methyl-2-(methylthio)- |
1.516 |
1 |
2 |
|
|
1.513 |
1 |
4 |
SF5CF3 |
Sulfur, pentafluoro(trifluoromethyl)- |
1.933 |
1 |
2 |