Geometry & MOs

Info

ID:	324110
PubChem CID:	126676937
Reduced:	FN2O3C27H29 (1)
Stoich.:	AB2C3D27E29 (1)
Weight, g/mol:	520.273736
ΔH_f, kcal/mol:	-107.8
Dipole, Da:	4.07
IP(EA), eV:	-8.97(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[(3S,4R)-4-[4-[2-(4-fluorophenyl)ethoxy]phenyl]piperidin-3-yl]methoxy]-N-(3-methoxypropyl)benzamide

Drug info:

PubChemData

Smile

CNC(=O)C1=CC=C(C=C1)OC[C@@H]2CNCC[C@H]2C3=CC=C(C=C3)OCC4=CC=C(C=C4)F

DOS

IR

Vibrations