(7S)-7-(4H-Indol-1-Ium-4-Id-3-Ylmethyl)-7,14-Dihydroquinazolino[3,2-D][1,4]Benzodiazepine-5,14A-Diide-6,9-Dione

Molecule SVG Image

Properties Simple | Detailed

Formula C25H20N4O2
IUPAC Name (7s)-7-(4h-indol-1-ium-4-id-3-ylmethyl)-7,14-dihydroquinazolino[3,2-d][1,4]benzodiazepine-5,14a-diide-6,9-dione
Molecular Mass 408.452 g·mol−1
Heat of Formation 219.1 ± 16.7 kJ·mol−1
Dipole Moment 10.97 ± 1.08 D
Volume 463.04 Å 3
Surface Area 346.96 Å 2
HOMO Energy -8.29 ± 0.55 eV
LUMO Energy 1.67 ± eV
Point Group Symmetry C1
InChIKey FHUIPHAVTQAQDP-UGNFMNBCSA-P
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N