N-[2-(3,4-Dichlorophenyl)-4-(3-Oxo-3,4-Dihydro-1'H,2H-Spiro[Isoquinoline-1,4'-Piperidin]-1'-Yl)Butyl]-3,4,5-Trimethoxy-N-Methylbenzamide
Properties
Property | Value |
---|---|
Formula | C34H39Cl2N3O5 |
IUPAC Name | n-[(2s)-2-(3,4-dichlorophenyl)-4-(3-oxospiro[2,4-dihydroisoquinoline-1,4'-piperidine]-1'-yl)butyl]-3,4,5-trimethoxy-n-methyl-benzamide |
Molecular Mass | 640.597 g·mol−1 |
Heat of Formation | -702.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.13 ± 1.08 D |
Volume | 732.63 Å 3 |
Surface Area | 493.32 Å 2 |
HOMO Energy | -8.93 ± 0.55 eV |
LUMO Energy | 2.43 ± eV |
Point Group Symmetry | C1 |
InChIKey | RMRHFQVHSFCBEO-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 |