Geometry & MOs

Info

ID:	334607
PubChem CID:	127253282
Reduced:	NO7H21C24 (1)
Stoich.:	AB7C21D24 (1)
Weight, g/mol:	450.157957
ΔH_f, kcal/mol:	-232.23
Dipole, Da:	8.11
IP(EA), eV:	-9.26(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[2-(1H-indol-3-yl)ethyl]-3,4-dimethoxyindeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

CC1=C(C(=C2C(=C1O)[C@@]3(C(=CC(=O)/C(=C(\C)/NC4=CC(=CC=C4)O)/C3=O)O2)C)C(=O)C)O

DOS

IR

Vibrations