Geometry & MOs

Info

ID:	324109
PubChem CID:	126676936
Reduced:	N2O3C26H28 (1)
Stoich.:	A2B3C26D28 (1)
Weight, g/mol:	448.216221
ΔH_f, kcal/mol:	-55.55
Dipole, Da:	5.38
IP(EA), eV:	-8.83(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[(3S,4R)-4-[4-[(4-fluorophenyl)methoxy]phenyl]piperidin-3-yl]methoxy]-N-methylbenzamide

Drug info:

PubChemData

Smile

C1CNC[C@H]([C@@H]1C2=CC=C(C=C2)OCC3=CC=CC=C3)COC4=CC=C(C=C4)C(=O)N

DOS

IR

Vibrations