Geometry & MOs

Info

ID:	251292
PubChem CID:	103102803
Reduced:	O3N4C9H12 (1)
Stoich.:	A3B4C9D12 (1)
Weight, g/mol:	223.095691
ΔH_f, kcal/mol:	-83.82
Dipole, Da:	4.98
IP(EA), eV:	-9.52(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-amino-2-oxoethyl)-ethylamino]pyridine-2-carboxylic acid

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C1=NN=C(C=C1)C(=O)O

DOS

IR

Vibrations