(5Z,7Z)-9,10-Secopregna-5,7,10-Triene-1,3-Diol
Properties
| Property | Value |
|---|---|
| Formula | C21H32O2 |
| IUPAC Name | (1r,3s,5z)-5-[(2e)-2-[(1s,3as,7ar)-1-ethyl-7a-methyl-2,3,3a,5,6,7-hexahydro-1h-inden-4-ylidene]ethylidene]-4-methylene-cyclohexane-1,3-diol |
| Molecular Mass | 316.478 g·mol−1 |
| Heat of Formation | -429.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.31 ± 1.08 D |
| Volume | 426.75 Å 3 |
| Surface Area | 350.81 Å 2 |
| HOMO Energy | -8.59 ± 0.55 eV |
| LUMO Energy | 3.11 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | XMDLIEZJERQGEY-ZHFUSYIKSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |