Geometry & MOs

Info

ID:	210786
PubChem CID:	80856077
Reduced:	O3N6C10H14 (1)
Stoich.:	A3B6C10D14 (1)
Weight, g/mol:	248.127326
ΔH_f, kcal/mol:	-82.21
Dipole, Da:	3.8
IP(EA), eV:	-9.88(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[6-(propylamino)pyridin-2-yl]piperazine-2,6-dione

Drug info:

PubChemData

Smile

CN1C(=O)CCC(C1=O)NC2=NC(=NC(=N2)N)OC

DOS

IR

Vibrations