S-(3,3-Dimethylbutyl) 5-Methylhexanethioate
Properties
Property | Value |
---|---|
Formula | C13H26OS |
IUPAC Name | s-(3,3-dimethylbutyl) 5-methylhexanethioate |
Molecular Mass | 230.410 g·mol−1 |
Heat of Formation | -422.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 0.79 ± 1.08 D |
Volume | 330.08 Å 3 |
Surface Area | 307.6 Å 2 |
HOMO Energy | -9.08 ± 0.55 eV |
LUMO Energy | 2.60 ± eV |
Point Group Symmetry | C1 |
InChIKey | MPLVQKUBFSRKMC-UHFFFAOYSA-N |
QR Code | Generate QR Code |
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Elements | H C S O |