S-[(1R)-1-Methylbutyl] (1S,2S)-2-Methylcyclobutanecarbothioate

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Properties Simple | Detailed

Formula C11H20OS
IUPAC Name s-[(1r)-1-methylbutyl] (1s,2s)-2-methylcyclobutanecarbothioate
Molecular Mass 200.341 g·mol−1
Heat of Formation -282.6 ± 16.7 kJ·mol−1
Dipole Moment 0.79 ± 1.08 D
Volume 272.93 Å 3
Surface Area 257.32 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy 2.69 ± eV
Point Group Symmetry C1
InChIKey XKVPIKONRIXTQS-AEJSXWLSSA-N
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Elements H C S O