(2S)-1-[(1S)-2,2-Dimethylcyclobutyl]-2-Methyl-Pentane-1-Thione

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Properties Simple | Detailed

Formula C12H22S
IUPAC Name (2s)-1-[(1s)-2,2-dimethylcyclobutyl]-2-methyl-pentane-1-thione
Molecular Mass 198.368 g·mol−1
Heat of Formation -46.8 ± 16.7 kJ·mol−1
Dipole Moment 2.94 ± 1.08 D
Volume 283.86 Å 3
Surface Area 249.65 Å 2
HOMO Energy -8.46 ± 0.55 eV
LUMO Energy 2.12 ± eV
Point Group Symmetry C1
InChIKey JLFUINYBLOSJNS-VHSXEESVSA-N
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Elements H C S