Geometry & MOs

Info

ID:	136743
PubChem CID:	52092379
Reduced:	NO7H27C29 (1)
Stoich.:	AB7C27D29 (1)
Weight, g/mol:	292.144987
ΔH_f, kcal/mol:	-194.81
Dipole, Da:	5.99
IP(EA), eV:	-9.04(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

4-[(6,8-dimethylquinolin-1-ium-4-yl)amino]benzamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC4=C3CN(CO4)CC5=CC=CC=C5OC)C

DOS

IR

Vibrations