Geometry & MOs

Info

ID:	360444
PubChem CID:	127301089
Reduced:	NOC10H15 (2)
Stoich.:	ABC10D15 (2)
Weight, g/mol:	249.147727
ΔH_f, kcal/mol:	-102.47
Dipole, Da:	2.37
IP(EA), eV:	-9.11(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,4-dimethylpiperazine-1-carbonyl)-1-methylpyridin-2-one

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)NC2(CCCC2)CNC(=O)C3(CCCC3)O

DOS

IR

Vibrations