(5Z,7Z)-9,10-Secocholesta-5,7,10-Triene-3-Thiol
Properties
| Property | Value |
|---|---|
| Formula | C27H44S |
| IUPAC Name | (1s,3z)-3-[(2z)-2-[(1r,3as,7as)-1-[(1r)-1,5-dimethylhexyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1h-inden-4-ylidene]ethylidene]-4-methylene-cyclohexanethiol |
| Molecular Mass | 400.703 g·mol−1 |
| Heat of Formation | -196.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.36 ± 1.08 D |
| Volume | 566.89 Å 3 |
| Surface Area | 450.0 Å 2 |
| HOMO Energy | -8.81 ± 0.55 eV |
| LUMO Energy | 2.73 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KNKNYIIMSXZCGO-BJYVWPNASA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C |