(1R,3S,5E)-5-{(2E)-2-[(3As,7Ar)-1-(6,6-Difluoro-7-Hydroxy-7-Methyl-2-Octanyl)-7A-Methyloctahydro-4H-Inden-4-Ylidene]Ethylidene}-4-Methylene-1,3-Cyclohexanediol
Properties
Property | Value |
---|---|
Formula | C28H44F2O3 |
IUPAC Name | (5z)-5-[(2e)-2-[1-(5,5-difluoro-6-hydroxy-1,6-dimethyl-heptyl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1h-inden-4-ylidene]ethylidene]-4-methylene-cyclohexane-1,3-diol |
Molecular Mass | 466.644 g·mol−1 |
Heat of Formation | 2903.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.58 ± 1.08 D |
Volume | 491.47 Å 3 |
Surface Area | 426.26 Å 2 |
HOMO Energy | -8.98 ± 0.55 eV |
LUMO Energy | -2.46 ± eV |
Point Group Symmetry | C1 |
InChIKey | BYSQJLGAMANIHA-FOODPTGNSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O F |