Geometry & MOs

Info

ID:	334277
PubChem CID:	127252829
Reduced:	O2N3C21H27 (1)
Stoich.:	A2B3C21D27 (1)
Weight, g/mol:	412.142307
ΔH_f, kcal/mol:	-56.37
Dipole, Da:	1.97
IP(EA), eV:	-8.78(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dimethoxy-6-(2-pyridin-4-ylethyl)indeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

CNC(=O)[C@@H]1CC2=CC=CC=C2CN1C(=O)CCCCCN3C=CC=C3

DOS

IR

Vibrations