Geometry & MOs

Info

ID:	345488
PubChem CID:	127269788
Reduced:	ON5C21H27 (1)
Stoich.:	AB5C21D27 (1)
Weight, g/mol:	286.131742
ΔH_f, kcal/mol:	24.55
Dipole, Da:	7.03
IP(EA), eV:	-8.95(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(2-oxopyrrolidin-1-yl)benzoyl]piperidin-4-one

Drug info:

PubChemData

Smile

C1CCC(C1)(CNC(=O)N2CCN(CC2)C3=NN=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations