Geometry & MOs

Info

ID:	302036
PubChem CID:	124338697
Reduced:	ClFON2C19H20 (1)
Stoich.:	ABCD2E19F20 (1)
Weight, g/mol:	360.140469
ΔH_f, kcal/mol:	-59.72
Dipole, Da:	5.34
IP(EA), eV:	-8.96(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chloro-2-methylphenyl)-1-[(4-fluorophenyl)methyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)NC2=CC(=CC=C2)Cl)CC3=CC=C(C=C3)F

DOS

IR

Vibrations