Geometry & MOs

Info

ID:	188210
PubChem CID:	77682176
Reduced:	OCl2N2C19H24 (1)
Stoich.:	AB2C2D19E24 (1)
Weight, g/mol:	314.235814
ΔH_f, kcal/mol:	-42.12
Dipole, Da:	2.06
IP(EA), eV:	-8.95(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[4-(1-phenylpropan-2-yl)piperidin-1-yl]methyl]piperidin-2-one

Drug info:

PubChemData

Smile

C1CN(CCC1C=CC2=CC=CC=C2Cl)CC3CC(CNC3=O)Cl

DOS

IR

Vibrations