Geometry & MOs

Info

ID:	7231
PubChem CID:	71647
Reduced:	NI2H3O5C7 (1)
Stoich.:	AB2C3D5E7 (1)
Weight, g/mol:	434.81007
ΔH_f, kcal/mol:	-127.42
Dipole, Da:	3.05
IP(EA), eV:	-10.04(-2.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-diiodo-4-oxo-1H-pyridine-2,6-dicarboxylic acid

Drug info:

PubChemData

Smile

C1(=C(NC(=C(C1=O)I)C(=O)O)C(=O)O)I

DOS

IR

Vibrations