Geometry & MOs

Info

ID:	213903
PubChem CID:	81065534
Reduced:	NO2C7H10 (2)
Stoich.:	AB2C7D10 (2)
Weight, g/mol:	264.147393
ΔH_f, kcal/mol:	-196.98
Dipole, Da:	8.03
IP(EA), eV:	-9.4(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3-pyridin-3-ylpropanoylamino)methyl]pentanoic acid

Drug info:

PubChemData

Smile

CCC(CC(=O)O)CNC(=O)C1=C(C=C(NC1=O)C)C

DOS

IR

Vibrations