Geometry & MOs

Info

ID:	213462
PubChem CID:	81063823
Reduced:	NF2O3C14H17 (1)
Stoich.:	AB2C3D14E17 (1)
Weight, g/mol:	263.152144
ΔH_f, kcal/mol:	-226.98
Dipole, Da:	3.92
IP(EA), eV:	-9.99(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3-phenylpropanoylamino)methyl]pentanoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations