Geometry & MOs

Info

ID:	246075
PubChem CID:	103042437
Reduced:	ClNF2C9H10 (1)
Stoich.:	ABC2D9E10 (1)
Weight, g/mol:	259.093933
ΔH_f, kcal/mol:	-92.0
Dipole, Da:	1.84
IP(EA), eV:	-9.66(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(3-chloro-4-fluorophenyl)-1-fluoroethyl]piperidine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1CC(CN)F)Cl)F

DOS

IR

Vibrations