S-[(1R,2R)-2-Methylcyclobutyl] 5-Methylhexanethioate
Properties
Property | Value |
---|---|
Formula | C12H22OS |
IUPAC Name | s-[(1r,2r)-2-methylcyclobutyl] 5-methylhexanethioate |
Molecular Mass | 214.367 g·mol−1 |
Heat of Formation | -304.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 0.80 ± 1.08 D |
Volume | 296.19 Å 3 |
Surface Area | 280.79 Å 2 |
HOMO Energy | -9.10 ± 0.55 eV |
LUMO Energy | 2.64 ± eV |
Point Group Symmetry | C1 |
InChIKey | UDLBLEKRORRTAU-GHMZBOCLSA-N |
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Elements | H C S O |