Geometry & MOs

Info

ID:	334241
PubChem CID:	127252793
Reduced:	O9H26C29 (1)
Stoich.:	A9B26C29 (1)
Weight, g/mol:	427.116821
ΔH_f, kcal/mol:	-244.57
Dipole, Da:	6.11
IP(EA), eV:	-8.19(-1.26)
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)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)/C=C\2/C(=O)C3=C(O2)C4=C(C=C3)OC(=O)CC4C5=CC(=C(C=C5OC)OC)OC)OC

DOS

IR

Vibrations