Geometry & MOs

Info

ID:	334996
PubChem CID:	127253802
Reduced:	N3O6C22H23 (1)
Stoich.:	A3B6C22D23 (1)
Weight, g/mol:	469.188923
ΔH_f, kcal/mol:	-183.37
Dipole, Da:	3.29
IP(EA), eV:	-8.57(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dimethoxy-6-[[4-(2-methylpropoxy)phenyl]methyl]indeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=O)N1CCC2=CN=CN2)C(CC(=O)OC)C3=CC4=C(C=C3)OCO4)O

DOS

IR

Vibrations