Geometry & MOs

Info

ID:	213973
PubChem CID:	81065610
Reduced:	FN2O3C15H21 (1)
Stoich.:	AB2C3D15E21 (1)
Weight, g/mol:	296.153621
ΔH_f, kcal/mol:	-182.75
Dipole, Da:	4.75
IP(EA), eV:	-9.6(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[1-(3-fluorophenyl)ethylcarbamoylamino]methyl]pentanoic acid

Drug info:

PubChemData

Smile

CCC(CC(=O)O)CNC(=O)NC(C)C1=CC=CC=C1F

DOS

IR

Vibrations