Geometry & MOs

Info

ID:	83521
PubChem CID:	49857695
Reduced:	NO3C17H17 (1)
Stoich.:	AB3C17D17 (1)
Weight, g/mol:	288.09102
ΔH_f, kcal/mol:	-100.1
Dipole, Da:	2.11
IP(EA), eV:	-9.42(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-fluorophenyl)-3-(pyridine-3-carbonylamino)propanoic acid

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(CC(=O)O)NC(=O)C2=CC=CC=C2

DOS

IR

Vibrations