N-(4-{[(5R)-7-Chloro-5-Hydroxy-2,3,4,5-Tetrahydro-1H-1-Benzazepin-1-Yl]Carbonyl}-3-Methylphenyl)-2-Methylbenzamide
Properties
Property | Value |
---|---|
Formula | C26H25ClN2O3 |
IUPAC Name | n-[4-[(5r)-7-chloro-5-hydroxy-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]-3-methyl-phenyl]-2-methyl-benzamide |
Molecular Mass | 448.941 g·mol−1 |
Heat of Formation | -367.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 9.19 ± 1.08 D |
Volume | 527.8 Å 3 |
Surface Area | 439.5 Å 2 |
HOMO Energy | -9.12 ± 0.55 eV |
LUMO Energy | 2.41 ± eV |
Point Group Symmetry | C1 |
Synonyms |
|
CAS Number(s) |
|
InChIKey | GYHCTFXIZSNGJT-XMMPIXPASA-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 |