Geometry & MOs

Info

ID:	158204
PubChem CID:	56463156
Reduced:	FSN3O6H18C21 (1)
Stoich.:	ABC3D6E18F21 (1)
Weight, g/mol:	433.054398
ΔH_f, kcal/mol:	-205.24
Dipole, Da:	8.39
IP(EA), eV:	-8.83(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-5-[[5-fluoro-2-(pyridine-2-carbonylamino)phenyl]sulfamoyl]benzoic acid

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)S(=O)(=O)NC2=C(C=CC(=C2)F)NC(=O)C3=CC=CC=N3)OCC(=O)O

DOS

IR

Vibrations