Geometry & MOs

Info

ID:	251309
PubChem CID:	103102963
Reduced:	N3O3C12H17 (1)
Stoich.:	A3B3C12D17 (1)
Weight, g/mol:	237.111341
ΔH_f, kcal/mol:	-103.62
Dipole, Da:	3.95
IP(EA), eV:	-9.45(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[[(2-amino-2-oxoethyl)-ethylamino]methyl]pyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

CCN(CC1=NC=C(C=C1)C(=O)OC)CC(=O)N

DOS

IR

Vibrations