Geometry & MOs

Info

ID:	246215
PubChem CID:	103049973
Reduced:	FNCl2C12H14 (1)
Stoich.:	ABC2D12E14 (1)
Weight, g/mol:	287.064383
ΔH_f, kcal/mol:	-52.84
Dipole, Da:	0.51
IP(EA), eV:	-9.26(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-8-[(5-chloro-2-fluorophenyl)methyl]-8-azabicyclo[3.2.1]octane

Drug info:

PubChemData

Smile

C1CN(CC1CCl)CC2=C(C=CC(=C2)Cl)F

DOS

IR

Vibrations