1-[(1S)-2,2-Dimethylcyclopropyl]-4,4-Dimethyl-Pentane-1-Thione

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Properties Simple | Detailed

Formula C12H22S
IUPAC Name 1-[(1s)-2,2-dimethylcyclopropyl]-4,4-dimethyl-pentane-1-thione
Molecular Mass 198.368 g·mol−1
Heat of Formation -27.8 ± 16.7 kJ·mol−1
Dipole Moment 3.45 ± 1.08 D
Volume 292.37 Å 3
Surface Area 251.31 Å 2
HOMO Energy -8.49 ± 0.55 eV
LUMO Energy -1.15 ± eV
Point Group Symmetry C1
InChIKey FCXONIFBPZYBRD-SECBINFHSA-N
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Elements H C S