Geometry & MOs

Info

ID:	276390
PubChem CID:	103822960
Reduced:	BrFSO2N3H7C9 (1)
Stoich.:	ABCD2E3F7G9 (1)
Weight, g/mol:	378.89839
ΔH_f, kcal/mol:	-60.37
Dipole, Da:	4.0
IP(EA), eV:	-9.38(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-bromo-6-fluorophenyl)sulfamoyl]thiophene-2-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Br)NS(=O)(=O)C2=CN=CN2)F

DOS

IR

Vibrations