Geometry & MOs

Info

ID:	319756
PubChem CID:	126657192
Reduced:	NH9C13 (1)
Stoich.:	AB9C13 (1)
Weight, g/mol:	406.116486
ΔH_f, kcal/mol:	80.14
Dipole, Da:	1.85
IP(EA), eV:	-9.06(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-benzamido-6-[[hydroxy(phenyl)methyl]amino]benzene-1,3-dicarboxylic acid

Drug info:

PubChemData

Smile

C=C1C2=CC=CC=C2C3=C1N=CC=C3

DOS

IR

Vibrations