(7R)-5-Chloro-3-[(1E,3E)-3,5-Dimethyl-1,3-Heptadien-1-Yl]-8-Methoxy-7-Methyl-6-Oxo-6,7-Dihydro-7-Isoquinolinyl Acetate
Properties
Property | Value |
---|---|
Formula | C22H26ClNO4 |
IUPAC Name | [(7r)-5-chloro-3-[(1e,3e,5r)-3,5-dimethylhepta-1,3-dienyl]-8-methoxy-7-methyl-6-oxo-7-isoquinolyl] acetate |
Molecular Mass | 403.899 g·mol−1 |
Heat of Formation | -479.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.55 ± 1.08 D |
Volume | 486.11 Å 3 |
Surface Area | 421.35 Å 2 |
HOMO Energy | -8.45 ± 0.55 eV |
LUMO Energy | -1.83 ± eV |
Point Group Symmetry | C1 |
InChIKey | XEYGOCHZSYIFRN-TVTPIZBSSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N O Cl |