Geometry & MOs

Info

ID:	6592
PubChem CID:	69116
Reduced:	NI2O2H5C7 (1)
Stoich.:	AB2C2D5E7 (1)
Weight, g/mol:	388.84097
ΔH_f, kcal/mol:	-31.59
Dipole, Da:	2.93
IP(EA), eV:	-9.17(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-3,5-diiodobenzoic acid

Drug info:

PubChemData

Smile

C1=C(C=C(C(=C1C(=O)O)N)I)I

DOS

IR

Vibrations