S-[(1S)-2,2-Dimethylcyclopropyl] (1R)-2,2-Dimethylcyclobutanecarbothioate

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Properties Simple | Detailed

Formula C12H20OS
IUPAC Name s-[(1s)-2,2-dimethylcyclopropyl] (1r)-2,2-dimethylcyclobutanecarbothioate
Molecular Mass 212.352 g·mol−1
Heat of Formation -176.7 ± 16.7 kJ·mol−1
Dipole Moment 1.32 ± 1.08 D
Volume 287.9 Å 3
Surface Area 256.76 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy 2.78 ± eV
Point Group Symmetry C1
InChIKey LGUUTHOLRCDRGZ-IUCAKERBSA-N
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Elements H C S O