(1R,3S,5Z)-5-[(2E)-2-{(1R,3As,7Ar)-1-[(2R)-8-Hydroxy-8-Methyl-2-Nonanyl]-7A-Methyloctahydro-4H-Inden-4-Ylidene}Ethylidene]-4-Methylene-1,3-Cyclohexanediol
Properties
Property | Value |
---|---|
Formula | C29H48O3 |
IUPAC Name | (1r,3s,5e)-5-[(2e)-2-[(1r,3as,7ar)-1-[(1r)-7-hydroxy-1,7-dimethyl-octyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1h-inden-4-ylidene]ethylidene]-4-methylene-cyclohexane-1,3-diol |
Molecular Mass | 444.690 g·mol−1 |
Heat of Formation | -770.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.35 ± 1.08 D |
Volume | 611.05 Å 3 |
Surface Area | 508.72 Å 2 |
HOMO Energy | -8.38 ± 0.55 eV |
LUMO Energy | 3.18 ± eV |
Point Group Symmetry | C1 |
InChIKey | NXSMZYQLQNEMOK-DVNFIFBASA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |