S-Isobutyl (1S,2S)-2-Methylcyclopropanecarbothioate

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Properties Simple | Detailed

Formula C9H16OS
IUPAC Name s-isobutyl (1s,2s)-2-methylcyclopropanecarbothioate
Molecular Mass 172.288 g·mol−1
Heat of Formation -193.3 ± 16.7 kJ·mol−1
Dipole Moment 0.95 ± 1.08 D
Volume 233.01 Å 3
Surface Area 227.53 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy 2.66 ± eV
Point Group Symmetry C1
InChIKey AALAMDQRSOULPN-YUMQZZPRSA-N
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Elements H C S O