S-(1-Methylcyclobutyl) (1R)-2,2-Dimethylcyclobutanecarbothioate

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Properties Simple | Detailed

Formula C12H20OS
IUPAC Name s-(1-methylcyclobutyl) (1r)-2,2-dimethylcyclobutanecarbothioate
Molecular Mass 212.352 g·mol−1
Heat of Formation -216.4 ± 16.7 kJ·mol−1
Dipole Moment 0.97 ± 1.08 D
Volume 286.1 Å 3
Surface Area 247.82 Å 2
HOMO Energy -9.03 ± 0.55 eV
LUMO Energy 2.71 ± eV
Point Group Symmetry C1
InChIKey RSHVHFBIIFXDBC-VIFPVBQESA-N
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Elements H C S O