Geometry & MOs

Info

ID:	353236
PubChem CID:	127284416
Reduced:	NOC5H7 (4)
Stoich.:	ABC5D7 (4)
Weight, g/mol:	343.16444
ΔH_f, kcal/mol:	-174.79
Dipole, Da:	1.96
IP(EA), eV:	-9.48(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[4-[3-(4-methylpyrazol-1-yl)propanoyl]piperazine-1-carbonyl]-1H-pyridin-2-one

Drug info:

PubChemData

Smile

CC(C(=O)N1CCN(CC1)C(=O)C2=CNC(=O)C=C2)NC(=O)C3CCCCC3

DOS

IR

Vibrations