Geometry & MOs

Info

ID:	278282
PubChem CID:	103834566
Reduced:	SN2O3C13H28 (1)
Stoich.:	AB2C3D13E28 (1)
Weight, g/mol:	317.109707
ΔH_f, kcal/mol:	-170.17
Dipole, Da:	1.84
IP(EA), eV:	-9.41(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(3-fluoro-4-methoxyphenyl)sulfonylpiperidin-4-yl]ethanol

Drug info:

PubChemData

Smile

CCCN(CCC)S(=O)(=O)N1CCC(CC1)C(C)O

DOS

IR

Vibrations