S-(2,2-Dimethylbutyl) (1R,2S)-2-Methylcyclobutanecarbothioate
Properties
Property | Value |
---|---|
Formula | C12H22OS |
IUPAC Name | s-(2,2-dimethylbutyl) (1r,2s)-2-methylcyclobutanecarbothioate |
Molecular Mass | 214.367 g·mol−1 |
Heat of Formation | -289.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.03 ± 1.08 D |
Volume | 294.63 Å 3 |
Surface Area | 262.6 Å 2 |
HOMO Energy | -8.99 ± 0.55 eV |
LUMO Energy | 2.73 ± eV |
Point Group Symmetry | C1 |
InChIKey | KDFNAARFOGRAST-VHSXEESVSA-N |
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Elements | H C S O |