Geometry & MOs

Info

ID:	6936
PubChem CID:	70565
Reduced:	NI2O4C11H11 (1)
Stoich.:	AB2C4D11E11 (1)
Weight, g/mol:	474.87775
ΔH_f, kcal/mol:	-131.08
Dipole, Da:	6.56
IP(EA), eV:	-9.4(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-acetamido-3-(4-hydroxy-3,5-diiodophenyl)propanoic acid

Drug info:

PubChemData

Smile

CC(=O)NC(CC1=CC(=C(C(=C1)I)O)I)C(=O)O

DOS

IR

Vibrations