Geometry & MOs

Info

ID:	89823
PubChem CID:	49964844
Reduced:	SN2O2C16H20 (1)
Stoich.:	AB2C2D16E20 (1)
Weight, g/mol:	313.088498
ΔH_f, kcal/mol:	-6.72
Dipole, Da:	15.54
IP(EA), eV:	-7.48(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-aminophenyl)sulfonyl-(1-methylquinolin-1-ium-6-yl)azanide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)[N-]C2=CC=C(C=C2)[N+](C)(C)C

DOS

IR

Vibrations