Geometry & MOs

Info

ID:	334697
PubChem CID:	127253372
Reduced:	NO6C25H27 (1)
Stoich.:	AB6C25D27 (1)
Weight, g/mol:	408.133474
ΔH_f, kcal/mol:	-155.9
Dipole, Da:	5.15
IP(EA), eV:	-8.56(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[2-(7H-purin-6-ylamino)ethyl]indeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

CC(C)C(C1=CC(=C(C=C1)OC)OC)NC(=O)C2=CC(=O)C(=CO2)OCC3=CC=CC=C3

DOS

IR

Vibrations