Geometry & MOs

Info

ID:	53903
PubChem CID:	14718342
Reduced:	N4C18H19 (1)
Stoich.:	A4B18C19 (1)
Weight, g/mol:	291.160972
ΔH_f, kcal/mol:	114.39
Dipole, Da:	2.51
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.597095
Charge, e:	1

Chem-info

IUPAC name:

N,N-dimethyl-4-[(1-methylquinolin-1-ium-8-yl)diazenyl]aniline

Drug info:

PubChemData

Smile

C[N+]1=CC(=CC2=CC=CC=C21)N=NC3=CC=C(C=C3)N(C)C

DOS

IR

Vibrations