Geometry & MOs

Info

ID:	209712
PubChem CID:	80707016
Reduced:	O2N3C14H21 (1)
Stoich.:	A2B3C14D21 (1)
Weight, g/mol:	269.124964
ΔH_f, kcal/mol:	-70.96
Dipole, Da:	4.91
IP(EA), eV:	-8.77(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-fluorophenyl)sulfanylethyl]-4-methylpiperidin-4-ol

Drug info:

PubChemData

Smile

CC(C)N1CCC(C1)CNC(=O)C2=C(C=NC=C2)O

DOS

IR

Vibrations