[(2R,3S,4R,5R,10S)-5,10-Dihydroxy-6,8-Dimethoxy-2-(4-Methoxyphenyl)-3-Phenyl-2,3,4,5-Tetrahydro-2,5-Methano-1-Benzoxepin-4-Yl][(2S)-2-Methoxypyrrolidin-1-Yl]Methanone
Properties
Property | Value |
---|---|
Formula | C32H35NO8 |
IUPAC Name | [(2r,3s,4r,5r,10s)-5,10-dihydroxy-6,8-dimethoxy-2-(4-methoxyphenyl)-3-phenyl-2,3,4,5-tetrahydro-2,5-methano-1-benzoxepin-4-yl][(2s)-2-methoxypyrrolidin-1-yl]methanone |
Molecular Mass | 561.622 g·mol−1 |
Heat of Formation | -1136.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.41 ± 1.08 D |
Volume | 644.27 Å 3 |
Surface Area | 480.57 Å 2 |
HOMO Energy | -8.72 ± 0.55 eV |
LUMO Energy | 3.19 ± eV |
Point Group Symmetry | C1 |
InChIKey | OLDQJFAOLFTZIG-QEQDXXSVSA-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 |