Geometry & MOs

Info

ID:	128557
PubChem CID:	51049850
Reduced:	ON2C20H22 (1)
Stoich.:	AB2C20D22 (1)
Weight, g/mol:	469.207608
ΔH_f, kcal/mol:	23.05
Dipole, Da:	5.48
IP(EA), eV:	-8.27(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[3-(3-methoxyphenoxy)propyl]piperidin-4-yl]-phenylmethanol;2,2,2-trifluoroacetic acid

Drug info:

PubChemData

Smile

CCCC1=C(N=CN1CC2=CC=CC=C2OC)C3=CC=CC=C3

DOS

IR

Vibrations