Geometry & MOs

Info

ID:	334053
PubChem CID:	127252605
Reduced:	O4N5H29C30 (1)
Stoich.:	A4B5C29D30 (1)
Weight, g/mol:	442.116486
ΔH_f, kcal/mol:	40.09
Dipole, Da:	5.82
IP(EA), eV:	-8.68(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dimethoxy-5,11-dioxoindeno[1,2-c]isoquinolin-6-yl)-2-hydroxybenzamide

Drug info:

PubChemData

Smile

C1[C@H]([C@@H]2C3CC(CN2C4=C1C=C(C=C4)[N+](=O)[O-])C5=CC=CC(=O)N5C3)C(=O)NCCC6=CNC7=CC=CC=C76

DOS

IR

Vibrations