(1S,3Z,5R,7S)-3-[Hydroxy(Phenyl)Methylene]-6,6-Dimethyl-1,5,7-Tris(3-Methyl-2-Buten-1-Yl)Bicyclo[3.3.1]Nonane-2,4,9-Trione
Properties
Property | Value |
---|---|
Formula | C33H42O4 |
IUPAC Name | (1s,3z,5s,7s)-3-[hydroxy(phenyl)methylene]-6,6-dimethyl-1,5,7-tris(3-methylbut-2-enyl)bicyclo[3.3.1]nonane-2,4,9-trione |
Molecular Mass | 502.684 g·mol−1 |
Heat of Formation | -386.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.82 ± 1.08 D |
Volume | 650.11 Å 3 |
Surface Area | 462.56 Å 2 |
HOMO Energy | -9.18 ± 0.55 eV |
LUMO Energy | 2.34 ± eV |
Point Group Symmetry | C1 |
InChIKey | KLFBRRJTELLZLW-CEPAZUQSSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |