Geometry & MOs

Info

ID:	384520
PubChem CID:	134977144
Reduced:	ON2H18C21 (1)
Stoich.:	AB2C18D21 (1)
Weight, g/mol:	282.116841
ΔH_f, kcal/mol:	61.41
Dipole, Da:	9.32
IP(EA), eV:	-8.98(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-fluorophenyl)-5-oxo-2-piperidin-1-ylcyclopenta-1,3-diene-1-carbonitrile

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=C(C(=O)C(=C2)C3=CC4=CC=CC=C4C=C3)C#N

DOS

IR

Vibrations