Geometry & MOs

Info

ID:	213902
PubChem CID:	81065533
Reduced:	N2O5C13H18 (1)
Stoich.:	A2B5C13D18 (1)
Weight, g/mol:	280.142307
ΔH_f, kcal/mol:	-197.95
Dipole, Da:	3.83
IP(EA), eV:	-9.88(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)amino]methyl]pentanoic acid

Drug info:

PubChemData

Smile

CCC(CC(=O)O)CNC(=O)CNC(=O)C1=CC=CO1

DOS

IR

Vibrations