5-Benzyl-5-Hydroxy-3-({3,4A,6-Trimethyl-2-[(2E,4E)-4-Methyl-2,4-Hexadien-2-Yl]-1,2,4A,5,6,7,8,8A-Octahydro-1-Naphthalenyl}Carbonyl)-1,5-Dihydro-2H-Pyrrol-2-One
Properties
Property | Value |
---|---|
Formula | C32H41NO3 |
IUPAC Name | (5r)-3-[(1r,2r,4as,6s,8ar)-2-[(1e,3e)-1,3-dimethylpenta-1,3-dienyl]-3,4a,6-trimethyl-2,5,6,7,8,8a-hexahydro-1h-naphthalene-1-carbonyl]-5-benzyl-5-hydroxy-1h-pyrrol-2-one |
Molecular Mass | 487.673 g·mol−1 |
Heat of Formation | -480.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.71 ± 1.08 D |
Volume | 643.4 Å 3 |
Surface Area | 467.36 Å 2 |
HOMO Energy | -9.19 ± 0.55 eV |
LUMO Energy | -0.81 ± eV |
Point Group Symmetry | C1 |
InChIKey | LERBUEGMFSDFOI-JZEKRPOVSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |