9-[8-(Isopropylamino)-1-Oxo-1,2,3,4-Tetrahydro-6-Isoquinolinyl]-2,7,7-Trimethyl-1,2,3,4,6,7,8,9-Octahydro-5H-β-Carbolin-5-One
Properties
Property | Value |
---|---|
Formula | C26H34N4O2 |
IUPAC Name | (2r)-9-[8-(isopropylamino)-1-oxo-3,4-dihydro-2h-isoquinolin-6-yl]-2,7,7-trimethyl-3,4,6,8-tetrahydro-1h-pyrido[3,4-b]indol-5-one |
Molecular Mass | 434.574 g·mol−1 |
Heat of Formation | -299.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.61 ± 1.08 D |
Volume | 545.54 Å 3 |
Surface Area | 440.19 Å 2 |
HOMO Energy | -8.38 ± 0.55 eV |
LUMO Energy | 2.40 ± eV |
Point Group Symmetry | C1 |
InChIKey | SAYWXJCRCITRBW-UHFFFAOYSA-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 |