Methyl (3Ar,3Bs,5Ar,6R,8As,8Bs,10Ar)-3A,5A-Dimethyl-6-[(2R)-6-Methyl-2-Heptanyl]-1-Oxohexadecahydrodicyclopenta[A,F]Naphthalene-3-Carboxylate
Properties
Property | Value |
---|---|
Formula | C28H46O3 |
IUPAC Name | methyl (3r,3ar,3bs,5ar,6r,8as,8bs,10ar)-6-[(1r)-1,5-dimethylhexyl]-3a,5a-dimethyl-1-oxo-3,3b,4,5,6,7,8,8a,8b,9,10,10a-dodecahydro-2h-indeno[6,7-e]indene-3-carboxylate |
Molecular Mass | 430.663 g·mol−1 |
Heat of Formation | -862.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.81 ± 1.08 D |
Volume | 580.61 Å 3 |
Surface Area | 451.98 Å 2 |
HOMO Energy | -9.89 ± 0.55 eV |
LUMO Energy | 0.85 ± eV |
Point Group Symmetry | C1 |
InChIKey | PJSICHQRUIZDEW-MYTAHINDSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |