Geometry & MOs

Info

ID:	276391
PubChem CID:	103822970
Reduced:	BrFNS2O4H7C11 (1)
Stoich.:	ABCD2E4F7G11 (1)
Weight, g/mol:	367.96304
ΔH_f, kcal/mol:	-143.24
Dipole, Da:	1.67
IP(EA), eV:	-9.3(-1.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromo-6-fluorophenyl)-4-(cyanomethyl)benzenesulfonamide

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Br)NS(=O)(=O)C2=CC=C(S2)C(=O)O)F

DOS

IR

Vibrations