Geometry & MOs

Info

ID:	89826
PubChem CID:	49964847
Reduced:	SN3O4H13C16 (1)
Stoich.:	AB3C4D13E16 (1)
Weight, g/mol:	344.070502
ΔH_f, kcal/mol:	16.68
Dipole, Da:	15.3
IP(EA), eV:	-8.18(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

N-(1-methylquinolin-1-ium-6-yl)-4-nitrobenzenesulfonamide

Drug info:

PubChemData

Smile

C[N+]1=CC=CC2=C1C=CC(=C2)[N-]S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

DOS

IR

Vibrations