S-[(1S,2S)-2-Methylcyclobutyl] 1-Methylcyclobutanecarbothioate

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Properties Simple | Detailed

Formula C11H18OS
IUPAC Name s-[(1s,2s)-2-methylcyclobutyl] 1-methylcyclobutanecarbothioate
Molecular Mass 198.325 g·mol−1
Heat of Formation -180.3 ± 16.7 kJ·mol−1
Dipole Moment 0.95 ± 1.08 D
Volume 262.77 Å 3
Surface Area 241.23 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy 2.69 ± eV
Point Group Symmetry C1
InChIKey SQMCXWXKEHEQGH-IUCAKERBSA-N
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