S-[(1S)-1-Methylbutyl] 3,3-Dimethylpentanethioate

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Properties Simple | Detailed

Formula C12H24OS
IUPAC Name s-[(1s)-1-methylbutyl] 3,3-dimethylpentanethioate
Molecular Mass 216.383 g·mol−1
Heat of Formation -401.4 ± 16.7 kJ·mol−1
Dipole Moment 0.59 ± 1.08 D
Volume 304.97 Å 3
Surface Area 277.71 Å 2
HOMO Energy -9.05 ± 0.55 eV
LUMO Energy 2.68 ± eV
Point Group Symmetry C1
InChIKey FPYFMBXDWRQQIM-JTQLQIEISA-N
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