Geometry & MOs

Info

ID:	359823
PubChem CID:	127299867
Reduced:	FON4C21H21 (1)
Stoich.:	ABC4D21E21 (1)
Weight, g/mol:	378.205576
ΔH_f, kcal/mol:	-1.01
Dipole, Da:	4.17
IP(EA), eV:	-8.84(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-methylpyridin-2-yl)-1-(2-oxo-1-phenylpyrrolidin-3-yl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CN(C(=O)C1N2CCN(CC2)C3=C(C(=CC=C3)F)C#N)C4=CC=CC=C4

DOS

IR

Vibrations