Geometry & MOs

Info

ID:	335153
PubChem CID:	127254014
Reduced:	NOH9C13 (2)
Stoich.:	ABC9D13 (2)
Weight, g/mol:	443.136887
ΔH_f, kcal/mol:	30.74
Dipole, Da:	5.19
IP(EA), eV:	-8.63(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[2-hydroxy-2-(3-hydroxyphenyl)ethyl]-3,4-dimethoxyindeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=C(C4=CC=CC=C4C3=O)N(C2=O)CCC5=CNC6=CC=CC=C65

DOS

IR

Vibrations