Geometry & MOs

Info

ID:	199006
PubChem CID:	79187015
Reduced:	FNSO5C11H12 (1)
Stoich.:	ABCD5E11F12 (1)
Weight, g/mol:	304.052921
ΔH_f, kcal/mol:	-231.28
Dipole, Da:	3.47
IP(EA), eV:	-10.19(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-acetamidoethylsulfamoyl)-3-fluorobenzoic acid

Drug info:

PubChemData

Smile

CNC(=O)CCS(=O)(=O)C1=C(C=C(C=C1)C(=O)O)F

DOS

IR

Vibrations