Gas Adsorption Sites in a Large-Pore Metal-Organic Framework

Author:

Rowsell Jesse L. C.1234,Spencer Elinor C.1234,Eckert Juergen1234,Howard Judith A. K.1234,Yaghi Omar M.1234

Affiliation:

1. Materials Design and Discovery Group, Department of Chemistry, University of Michigan, 930 North University Avenue, Ann Arbor, MI 48109, USA.

2. Department of Chemistry, University of Durham, South Road, Durham DH1 3LE, UK.

3. Materials Research Laboratory, University of California, Santa Barbara, CA 93106, USA.

4. Los Alamos Neutron Science Center–12, Mail Stop H805, Los Alamos National Laboratory, Los Alamos, NM 87545, USA.

Abstract

The primary adsorption sites for Ar and N 2 within metal-organic framework-5, a cubic structure composed of Zn 4 O(CO 2 ) 6 units and phenylene links defining large pores 12 and 15 angstroms in diameter, have been identified by single-crystal x-ray diffraction. Refinement of data collected between 293 and 30 kelvin revealed a total of eight symmetry-independent adsorption sites. Five of these are sites on the zinc oxide unit and the organic link; the remaining three sites form a second layer in the pores. The structural integrity and high symmetry of the framework are retained throughout, with negligible changes resulting from gas adsorption.

Publisher

American Association for the Advancement of Science (AAAS)

Subject

Multidisciplinary

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