(1R,3E,5S,7R)-3-[(3,4-Dihydroxyphenyl)-Hydroxy-Methylene]-1,5-Bis[(2E)-3,7-Dimethylocta-2,6-Dienyl]-6,6-Dimethyl-7-(3-Methylbut-2-Enyl)Bicyclo[3.3.1]Nonane-2,4,9-Trione

Molecule SVG Image

Properties Simple | Detailed

Formula C43H58O6
IUPAC Name (1r,3e,5s,7r)-3-[(3,4-dihydroxyphenyl)-hydroxy-methylene]-1,5-bis[(2e)-3,7-dimethylocta-2,6-dienyl]-6,6-dimethyl-7-(3-methylbut-2-enyl)bicyclo[3.3.1]nonane-2,4,9-trione
Molecular Mass 670.917 g·mol−1
Heat of Formation -1139.2 ± 16.7 kJ·mol−1
Dipole Moment 2.48 ± 1.08 D
Volume 873.57 Å 3
Surface Area 562.89 Å 2
HOMO Energy -8.90 ± 0.55 eV
LUMO Energy 1.97 ± eV
Point Group Symmetry C1
InChIKey RUKZGJLIZQTJGK-LVJPDZAGSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O