Geometry & MOs

Info

ID:	83364
PubChem CID:	49857499
Reduced:	ClNO3H14C16 (1)
Stoich.:	ABC3D14E16 (1)
Weight, g/mol:	299.115758
ΔH_f, kcal/mol:	-95.51
Dipole, Da:	5.92
IP(EA), eV:	-9.87(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-benzamido-3-(2-methoxyphenyl)propanoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations