Geometry & MOs

Info

ID:	19660
PubChem CID:	569933
Reduced:	NO4C18H19 (1)
Stoich.:	AB4C18D19 (1)
Weight, g/mol:	313.131408
ΔH_f, kcal/mol:	-137.67
Dipole, Da:	5.98
IP(EA), eV:	-9.69(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-benzamido-2-[hydroxy(phenyl)methyl]butanoic acid

Drug info:

PubChemData

Smile

CC(C(C(C1=CC=CC=C1)O)C(=O)O)NC(=O)C2=CC=CC=C2

DOS

IR

Vibrations