S-(3,3-Dimethylbutyl) 4-Methylpentanethioate

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Properties Simple | Detailed

Formula C12H24OS
IUPAC Name s-(3,3-dimethylbutyl) 4-methylpentanethioate
Molecular Mass 216.383 g·mol−1
Heat of Formation -401.7 ± 16.7 kJ·mol−1
Dipole Moment 0.72 ± 1.08 D
Volume 308.11 Å 3
Surface Area 287.34 Å 2
HOMO Energy -9.07 ± 0.55 eV
LUMO Energy 2.61 ± eV
Point Group Symmetry C1
InChIKey TWSSSSDORUVGNI-UHFFFAOYSA-N
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Elements H C S O