Geometry & MOs

Info

ID:	353229
PubChem CID:	127284409
Reduced:	O3N5C18H23 (1)
Stoich.:	A3B5C18D23 (1)
Weight, g/mol:	340.153541
ΔH_f, kcal/mol:	-75.97
Dipole, Da:	5.05
IP(EA), eV:	-9.28(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[4-[2-(6-methylpyridin-3-yl)acetyl]piperazine-1-carbonyl]-1H-pyridin-2-one

Drug info:

PubChemData

Smile

CC(C)C1=NN(C=C1C(=O)N2CCN(CC2)C(=O)C3=CNC(=O)C=C3)C

DOS

IR

Vibrations