Ab initio structure determination of [Eu5(C2H4O2)6(CH3CO2)3] n by X-ray powder diffraction

Author:

Abdallah Amal,Ammar SouadORCID,Ban Voraksmy,Sibille Romain,Francois Michel

Abstract

The compound [Eu5(C2H4O2)6(CH3CO2)3] n was synthesized by dissolving acetate europium salt in ethylene glycol solvent and heating under reflux for a short time. Its structure was solved ab initio from synchrotron powder diffraction data using optimization methods in direct space. The compound has a very large unit-cell volume of 23679 Å3 and the highest centred cubic symmetry space group, Ia{\bar 3}d (No. 230). The porous metal–organic framework structure is similar to those usually observed in zeolites, with pores volumes of 82 Å3, which is of potential interest for gas storage.

Publisher

International Union of Crystallography (IUCr)

Subject

Materials Chemistry,Metals and Alloys,Atomic and Molecular Physics, and Optics,Electronic, Optical and Magnetic Materials

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