Geometry & MOs

Info

ID:	334246
PubChem CID:	127252798
Reduced:	ClN3O7H24C25 (1)
Stoich.:	AB3C7D24E25 (1)
Weight, g/mol:	525.145534
ΔH_f, kcal/mol:	-222.91
Dipole, Da:	7.09
IP(EA), eV:	-9.14(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[3-[(7-chloroquinolin-4-yl)amino]propyl]-3,4-dimethoxyindeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

C[C@@H]1CC(=CC(=O)[C@]12C(=O)C3=C(O2)C(=C(C=C3OC)OC)Cl)NCC(=O)NC4=CC=C(C=C4)C(=O)N

DOS

IR

Vibrations