Geometry & MOs

Info

ID:	335018
PubChem CID:	127253824
Reduced:	N2O3H12C13 (2)
Stoich.:	A2B3C12D13 (2)
Weight, g/mol:	488.169585
ΔH_f, kcal/mol:	-108.01
Dipole, Da:	4.2
IP(EA), eV:	-8.56(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(9,10-dimethoxy-5,11-dioxo-6aH-isoindolo[2,1-a]quinazolin-6-yl)-N-(2-methoxypyridin-3-yl)propanamide

Drug info:

PubChemData

Smile

CC(C)C1=NOC(=N1)CNC(=O)CN2C3=C(C4=C(C2=O)C(=C(C=C4)OC)OC)C(=O)C5=CC=CC=C53

DOS

IR

Vibrations