(1R,5S,6R,7S)-5-Isobutyryl-6-Methyl-1,3,7-Tris(3-Methyl-2-Buten-1-Yl)-6-(4-Methyl-3-Penten-1-Yl)-4,9-Dioxobicyclo[3.3.1]Non-2-En-2-Yl Acetate
Properties
Property | Value |
---|---|
Formula | C37H54O5 |
IUPAC Name | [(1r,5s,6r,7s)-6-methyl-1,3,7-tris(3-methylbut-2-enyl)-6-(4-methylpent-3-enyl)-5-(2-methylpropanoyl)-4,9-dioxo-2-bicyclo[3.3.1]non-2-enyl] acetate |
Molecular Mass | 578.822 g·mol−1 |
Heat of Formation | -690.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.94 ± 1.08 D |
Volume | 773.76 Å 3 |
Surface Area | 547.87 Å 2 |
HOMO Energy | -8.89 ± 0.55 eV |
LUMO Energy | 2.95 ± eV |
Point Group Symmetry | C1 |
InChIKey | JZPNZEVHKFXJKG-NVGSILRDSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |