Geometry & MOs

Info

ID:	278106
PubChem CID:	103833401
Reduced:	FNSO4C12H16 (1)
Stoich.:	ABCD4E12F16 (1)
Weight, g/mol:	318.068571
ΔH_f, kcal/mol:	-194.79
Dipole, Da:	6.05
IP(EA), eV:	-9.8(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(2-acetamidoethylsulfamoyl)-4-fluorobenzoate

Drug info:

PubChemData

Smile

CC(C)CNS(=O)(=O)C1=C(C=CC(=C1)F)C(=O)OC

DOS

IR

Vibrations