Geometry & MOs

Info

ID:	214009
PubChem CID:	81065741
Reduced:	N3O5C12H17 (1)
Stoich.:	A3B5C12D17 (1)
Weight, g/mol:	279.158292
ΔH_f, kcal/mol:	-128.68
Dipole, Da:	5.07
IP(EA), eV:	-10.16(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[[6-(dimethylamino)pyridine-3-carbonyl]amino]methyl]pentanoic acid

Drug info:

PubChemData

Smile

CCC(CC(=O)O)CNC(=O)C1=CC=C(N1C)[N+](=O)[O-]

DOS

IR

Vibrations