Geometry & MOs

Info

ID:	280199
PubChem CID:	103847517
Reduced:	NSF2O4H9C13 (1)
Stoich.:	ABC2D4E9F13 (1)
Weight, g/mol:	329.019178
ΔH_f, kcal/mol:	-206.31
Dipole, Da:	8.39
IP(EA), eV:	-9.67(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2,5-dimethylthiophen-3-yl)sulfonylamino]-2-fluorobenzoic acid

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)F)S(=O)(=O)NC2=CC(=C(C=C2)C(=O)O)F

DOS

IR

Vibrations