(1R,3S,5R,7S,8R)-1-Benzoyl-6,6-Dimethyl-3,5-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,7s,8r)-1-benzoyl-6,6-dimethyl-3,5-bis(3-methylbut-2-enyl)-8-(2-methylprop-1-enyl)adamantane-2,4,9-trione |
| Molecular Mass | 500.668 g·mol−1 |
| Heat of Formation | -618.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.43 ± 1.08 D |
| Volume | 642.99 Å 3 |
| Surface Area | 435.41 Å 2 |
| HOMO Energy | -9.06 ± 0.55 eV |
| LUMO Energy | 3.08 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | HZHJUCBGNDWAOV-QRNABIBUSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |