Geometry & MOs

Info

ID:	283104
PubChem CID:	103958410
Reduced:	FNO4C16H22 (1)
Stoich.:	ABC4D16E22 (1)
Weight, g/mol:	345.137636
ΔH_f, kcal/mol:	-222.25
Dipole, Da:	3.81
IP(EA), eV:	-9.79(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-fluorophenyl)-2-[methyl(phenylmethoxycarbonyl)amino]butanoic acid

Drug info:

PubChemData

Smile

CCC(C1=CC=CC=C1F)(C(=O)O)N(C)C(=O)OC(C)(C)C

DOS

IR

Vibrations