Geometry & MOs

Info

ID:	283176
PubChem CID:	103962306
Reduced:	ISN2O5C10H11 (1)
Stoich.:	ABC2D5E10F11 (1)
Weight, g/mol:	425.97464
ΔH_f, kcal/mol:	-162.78
Dipole, Da:	1.9
IP(EA), eV:	-10.38(-1.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-iodo-5-[[2-oxo-2-(propan-2-ylamino)ethyl]sulfamoyl]benzoic acid

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1S(=O)(=O)NCCC(=O)N)C(=O)O)I

DOS

IR

Vibrations