(1R,3S,5E)-5-{(2E)-2-[(1R,3As,7Ar)-1-{(2R)-1-[3-(2-Hydroxy-2-Propanyl)Phenyl]-2-Propanyl}-7A-Methyloctahydro-4H-Inden-4-Ylidene]Ethylidene}-4-Methylene-1,3-Cyclohexanediol
Properties
| Property | Value |
|---|---|
| Formula | C31H44O3 |
| IUPAC Name | (1r,3s,5z)-5-[(2e)-2-[(1r,3as,7as)-7a-methyl-1-[(1r)-1-methyl-2-[3-(1-methyl-1-oxido-ethyl)phenyl]ethyl]-2,3,3a,5,6,7-hexahydro-1h-inden-4-ylidene]ethylidene]-4-methylene-cyclohexane-1,3-diolate |
| Molecular Mass | 464.679 g·mol−1 |
| Heat of Formation | -609.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.90 ± 1.08 D |
| Volume | 622.97 Å 3 |
| Surface Area | 492.25 Å 2 |
| HOMO Energy | -8.76 ± 0.55 eV |
| LUMO Energy | 3.38 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | PGFVHPGYHAXPEU-ZANOQQEASA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |