S-[(1S)-1-Methylbutyl] 5-Methylhexanethioate

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Properties Simple | Detailed

Formula C12H24OS
IUPAC Name s-[(1s)-1-methylbutyl] 5-methylhexanethioate
Molecular Mass 216.383 g·mol−1
Heat of Formation -404.5 ± 16.7 kJ·mol−1
Dipole Moment 0.75 ± 1.08 D
Volume 306.54 Å 3
Surface Area 290.48 Å 2
HOMO Energy -9.09 ± 0.55 eV
LUMO Energy 2.64 ± eV
Point Group Symmetry C1
InChIKey RTYRCOFEZWWHTO-NSHDSACASA-N
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Elements H C S O