S-Isohexyl (2S)-2-Methylbutanethioate

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Properties Simple | Detailed

Formula C11H22OS
IUPAC Name s-isohexyl (2s)-2-methylbutanethioate
Molecular Mass 202.357 g·mol−1
Heat of Formation -374.0 ± 16.7 kJ·mol−1
Dipole Moment 0.76 ± 1.08 D
Volume 286.46 Å 3
Surface Area 272.41 Å 2
HOMO Energy -9.11 ± 0.55 eV
LUMO Energy 2.63 ± eV
Point Group Symmetry C1
InChIKey FJPNAZGKJYBOBE-JTQLQIEISA-N
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Elements H C S O