1-[(1S)-2,2-Dimethylcyclobutyl]-3,3-Dimethyl-Butane-1-Thione

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Properties Simple | Detailed

Formula C12H22S
IUPAC Name 1-[(1s)-2,2-dimethylcyclobutyl]-3,3-dimethyl-butane-1-thione
Molecular Mass 198.368 g·mol−1
Heat of Formation -47.9 ± 16.7 kJ·mol−1
Dipole Moment 3.34 ± 1.08 D
Volume 284.31 Å 3
Surface Area 239.61 Å 2
HOMO Energy -8.40 ± 0.55 eV
LUMO Energy -1.09 ± eV
Point Group Symmetry C1
InChIKey KLQZQMLBZFQDJZ-SECBINFHSA-N
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Elements H C S