(4Ar,4Bs,6As,7S,10Br,11R)-7-Hydroxy-6A,11-Dimethyl-4,4A,4B,5,6,6A,7,10,10A,10B,11,12-Dodecahydro-2(3H)-Chrysenone
Properties
| Property | Value |
|---|---|
| Formula | C20H28O2 |
| IUPAC Name | (4ar,4bs,6as,7s,10as,10br,11r)-7-hydroxy-6a,11-dimethyl-3,4,4a,4b,5,6,7,10,10a,10b,11,12-dodecahydrochrysen-2-one |
| Molecular Mass | 300.435 g·mol−1 |
| Heat of Formation | -428.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.66 ± 1.08 D |
| Volume | 386.57 Å 3 |
| Surface Area | 308.79 Å 2 |
| HOMO Energy | -9.78 ± 0.55 eV |
| LUMO Energy | 0.01 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JAPLQPSAPOCMAS-TYXSOELRSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |