S-[(1S)-2,2-Dimethylcyclobutyl] 4-Methylpentanethioate

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Properties Simple | Detailed

Formula C12H22OS
IUPAC Name s-[(1s)-2,2-dimethylcyclobutyl] 4-methylpentanethioate
Molecular Mass 214.367 g·mol−1
Heat of Formation -308.7 ± 16.7 kJ·mol−1
Dipole Moment 0.98 ± 1.08 D
Volume 295.8 Å 3
Surface Area 273.11 Å 2
HOMO Energy -9.03 ± 0.55 eV
LUMO Energy 2.73 ± eV
Point Group Symmetry C1
InChIKey MLZQWIBRJRCZQK-JTQLQIEISA-N
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Elements H C S O