Geometry & MOs

Info

ID:	193646
PubChem CID:	78419016
Reduced:	OSN4C24H36 (1)
Stoich.:	ABC4D24E36 (1)
Weight, g/mol:	335.057592
ΔH_f, kcal/mol:	-62.85
Dipole, Da:	8.64
IP(EA), eV:	-8.37(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[2-cyanoethyl(methyl)sulfamoyl]-4-oxo-3H-quinoline-3-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CNC(=O)C2CCC(CC2)CNC3C4CCCCC4NC(=S)N3

DOS

IR

Vibrations