Geometry & MOs

Info

ID:	1533
PubChem CID:	4654
Reduced:	FNO2C9H10 (1)
Stoich.:	ABC2D9E10 (1)
Weight, g/mol:	183.069557
ΔH_f, kcal/mol:	-115.09
Dipole, Da:	2.71
IP(EA), eV:	-9.99(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-3-(4-fluorophenyl)propanoic acid

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CC(C(=O)O)N)F

DOS

IR

Vibrations