Geometry & MOs

Info

ID:	214011
PubChem CID:	81065750
Reduced:	ClFNO3C13H15 (1)
Stoich.:	ABCD3E13F15 (1)
Weight, g/mol:	250.131742
ΔH_f, kcal/mol:	-179.69
Dipole, Da:	2.66
IP(EA), eV:	-9.95(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(5-methylpyridine-3-carbonyl)amino]methyl]pentanoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations