Geometry & MOs

Info

ID:	213138
PubChem CID:	81062988
Reduced:	FNO3C13H16 (1)
Stoich.:	ABC3D13E16 (1)
Weight, g/mol:	251.115758
ΔH_f, kcal/mol:	-176.46
Dipole, Da:	4.61
IP(EA), eV:	-9.75(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-hydroxy-2-phenylacetyl)amino]-3-methylbutanoic acid

Drug info:

PubChemData

Smile

CC(CC(=O)O)CNC(=O)CC1=CC=C(C=C1)F

DOS

IR

Vibrations