S-[(1R,2R)-2-Methylcyclopropyl] (2R)-2-Methylbutanethioate

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Properties Simple | Detailed

Formula C9H16OS
IUPAC Name s-[(1r,2r)-2-methylcyclopropyl] (2r)-2-methylbutanethioate
Molecular Mass 172.288 g·mol−1
Heat of Formation -195.8 ± 16.7 kJ·mol−1
Dipole Moment 1.02 ± 1.08 D
Volume 232.77 Å 3
Surface Area 224.58 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy 2.64 ± eV
Point Group Symmetry C1
InChIKey ZNIXEJVIXUMWCQ-BWZBUEFSSA-N
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