S-[(1R,2R)-2-Methylcyclobutyl] 2,2-Dimethylpentanethioate

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Properties Simple | Detailed

Formula C12H22OS
IUPAC Name s-[(1r,2r)-2-methylcyclobutyl] 2,2-dimethylpentanethioate
Molecular Mass 214.367 g·mol−1
Heat of Formation -298.6 ± 16.7 kJ·mol−1
Dipole Moment 0.93 ± 1.08 D
Volume 293.23 Å 3
Surface Area 269.1 Å 2
HOMO Energy -9.01 ± 0.55 eV
LUMO Energy 2.74 ± eV
Point Group Symmetry C1
InChIKey IYLDEXSTTBANSW-NXEZZACHSA-N
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Elements H C S O