Geometry & MOs

Info

ID:	205154
PubChem CID:	80061587
Reduced:	SF3O3C14H17 (1)
Stoich.:	AB3C3D14E17 (1)
Weight, g/mol:	315.105978
ΔH_f, kcal/mol:	-266.41
Dipole, Da:	5.78
IP(EA), eV:	-10.22(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-chlorophenyl)-1-(3-methylsulfonylcyclohexyl)ethanamine

Drug info:

PubChemData

Smile

CS(=O)(=O)C1CCCC(C1)C(C2=CC(=C(C(=C2)F)F)F)O

DOS

IR

Vibrations