(1R,3S,5R,7R,8S)-5-Benzoyl-6,6-Dimethyl-1,3-Bis(3-Methyl-2-Buten-1-Yl)-8-(2-Methyl-1-Propen-1-Yl)-2,4,9-Adamantanetrione
Properties
| Property | Value |
|---|---|
| Formula | C33H40O4 |
| IUPAC Name | (1r,3s,5r,7r,8s)-5-(benzoyl)-6,6-dimethyl-1-(3-methylbut-3-enyl)-3-[[(1s)-2-methylenecyclopropyl]methyl]-8-(2-methylprop-1-enyl)adamantane-2,4,9-trione |
| Molecular Mass | 500.668 g·mol−1 |
| Heat of Formation | -615.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.61 ± 1.08 D |
| Volume | 641.03 Å 3 |
| Surface Area | 448.81 Å 2 |
| HOMO Energy | -9.10 ± 0.55 eV |
| LUMO Energy | 2.64 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OXIJJPXPEHKVOL-JMKBALHDSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |