(1R)-1-{4-[(9As)-Octahydro-2H-Pyrido[1,2-A]Pyrazin-2-Yl]Phenyl}-2-Phenyl-1,2,3,4-Tetrahydro-6-Isoquinolinol
Properties
Property | Value |
---|---|
Formula | C29H33N3O |
IUPAC Name | (1r,2r)-1-[4-[(2s,5s,9as)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl]phenyl]-2-phenyl-3,4-dihydro-1h-isoquinolin-6-ol |
Molecular Mass | 439.592 g·mol−1 |
Heat of Formation | 141.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.08 ± 1.08 D |
Volume | 549.28 Å 3 |
Surface Area | 451.07 Å 2 |
HOMO Energy | -8.29 ± 0.55 eV |
LUMO Energy | 3.20 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | ZGHFWBDHZZKWSI-LITSAYRRSA-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 |