Geometry & MOs

Info

ID:	89956
PubChem CID:	49965592
Reduced:	N2S2O7C19H22 (1)
Stoich.:	A2B2C7D19E22 (1)
Weight, g/mol:	343.111639
ΔH_f, kcal/mol:	-217.48
Dipole, Da:	11.1
IP(EA), eV:	-8.27(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

N-(6-methoxy-1-methylquinolin-1-ium-8-yl)-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NC2=C3C(=CC(=C2)OC)C=CC=[N+]3C.COS(=O)(=O)[O-]

DOS

IR

Vibrations