Geometry & MOs

Info

ID:	83763
PubChem CID:	49861106
Reduced:	ClNO3C24H34 (1)
Stoich.:	ABC3D24E34 (1)
Weight, g/mol:	401.212157
ΔH_f, kcal/mol:	-144.74
Dipole, Da:	5.87
IP(EA), eV:	-8.23(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-1-[4-[2-[(E)-2-phenylethenyl]phenoxy]butyl]piperidine;hydrochloride

Drug info:

PubChemData

Smile

CC(C)C(CCN[C@H]1CC2=CC(=C(C=C2C[C@@H]1O)OC)OC)C3=CC=CC=C3.Cl

DOS

IR

Vibrations