S-(1,1-Dimethylbutyl) (1S)-2,2-Dimethylcyclopropanecarbothioate

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Properties Simple | Detailed

Formula C12H22OS
IUPAC Name s-(1,1-dimethylbutyl) (1s)-2,2-dimethylcyclopropanecarbothioate
Molecular Mass 214.367 g·mol−1
Heat of Formation -275.5 ± 16.7 kJ·mol−1
Dipole Moment 0.33 ± 1.08 D
Volume 294.89 Å 3
Surface Area 267.51 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy 2.82 ± eV
Point Group Symmetry C1
InChIKey BBJHQPWCCCDIFV-SECBINFHSA-N
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Elements H C S O