Geometry & MOs

Info

ID:	201980
PubChem CID:	79612915
Reduced:	FNSO3C15H22 (1)
Stoich.:	ABCD3E15F22 (1)
Weight, g/mol:	315.130443
ΔH_f, kcal/mol:	-175.74
Dipole, Da:	3.47
IP(EA), eV:	-9.58(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-fluorophenyl)-1-(1-methylsulfonylpiperidin-3-yl)propan-2-ol

Drug info:

PubChemData

Smile

CC(CC1CCCN(C1)S(=O)(=O)C)(C2=CC(=CC=C2)F)O

DOS

IR

Vibrations