Geometry & MOs

Info

ID:	250090
PubChem CID:	103094044
Reduced:	BrClN2S2O4H6C10 (1)
Stoich.:	ABC2D2E4F6G10 (1)
Weight, g/mol:	437.8938
ΔH_f, kcal/mol:	-110.0
Dipole, Da:	9.85
IP(EA), eV:	-9.64(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(3-chloropyridin-2-yl)sulfamoyl]-2-iodobenzoic acid

Drug info:

PubChemData

Smile

C1=CC(=C(N=C1)NS(=O)(=O)C2=C(SC(=C2)C(=O)O)Br)Cl

DOS

IR

Vibrations