Geometry & MOs

Info

ID:	214070
PubChem CID:	81066878
Reduced:	FNO4C14H18 (1)
Stoich.:	ABC4D14E18 (1)
Weight, g/mol:	297.137636
ΔH_f, kcal/mol:	-208.86
Dipole, Da:	3.07
IP(EA), eV:	-9.34(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[[2-(3-fluoro-4-methoxyphenyl)acetyl]amino]methyl]pentanoic acid

Drug info:

PubChemData

Smile

CCC(CC(=O)O)CNC(=O)COC1=CC=C(C=C1)F

DOS

IR

Vibrations