Geometry & MOs

Info

ID:	137576
PubChem CID:	52229438
Reduced:	FON4C20H21 (1)
Stoich.:	ABC4D20E21 (1)
Weight, g/mol:	415.120192
ΔH_f, kcal/mol:	-10.45
Dipole, Da:	2.4
IP(EA), eV:	-9.46(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-4-oxo-1H-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CN(CC1=CC=C(C=C1)F)C(=O)NCC2=CC(=CC=C2)CN3C=CN=C3

DOS

IR

Vibrations