Geometry & MOs

Info

ID:	213889
PubChem CID:	81065520
Reduced:	NO5C15H21 (1)
Stoich.:	AB5C15D21 (1)
Weight, g/mol:	297.137636
ΔH_f, kcal/mol:	-198.92
Dipole, Da:	4.16
IP(EA), eV:	-8.78(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[3-(2-fluorophenoxy)propanoylamino]methyl]pentanoic acid

Drug info:

PubChemData

Smile

CCC(CC(=O)O)CNC(=O)C1=C(C(=CC=C1)OC)OC

DOS

IR

Vibrations