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In Situ Infrared Spectroscopic and Gravimetric Characterisation of the Solvent Removal and Dehydroxylation of the Metal Organic Frameworks UiO-66 and UiO-67

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Abstract

Herein, the desolvation, dehydroxylation and rehydroxylation of the metal organic frameworks UiO-66 and -67 are followed by in situ DRIFTS and TG–DSC. The spectra recorded on UiO-66 feature multiple bands corresponding to chemically inequivalent isolated hydroxyl groups, whereas UiO-67 has the expected single μ3-OH band from the Zr6O4(OH)4 cornerstone. Complete rehydration is demonstrated on both materials. Based on further experimental insights, hypotheses are given to explain the observed differences between UiO-66 and -67. Quantum chemical calculations are employed in order to deduce the feasibility of one possible explanation for the observed behaviour on UiO-66.

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Acknowledgments

Thanks are due to the Research Council of Norway for grant of computer time through the NOTUR project) account NN4683K). This publication forms a part of the inGAP Center of Research-based innovation, which receives financial support from the Research Council of Norway under Contract 174893.

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Authors and Affiliations

  1. Department of Chemistry, inGAP Center for Research Based Innovation, University of Oslo, P.O. Box 1033 Blindern, 0315, Oslo, Norway

    Greig C. Shearer, Sachin Chavan, Silvia Bordiga, Stian Svelle & Karl Petter Lillerud

  2. Department of Chemistry, Norwegian University of Science and Technology, Høgskoleringen 5, 7491, Trondheim, Norway

    Stian Forselv, Karina Mathisen & Morten Bjørgen

  3. Dipartimento di Chimica I.F.M, Via Giuria 7, 10125, Turin, Italy

    Silvia Bordiga

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  1. Greig C. Shearer
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  2. Stian Forselv
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  3. Sachin Chavan
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  4. Silvia Bordiga
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  5. Karina Mathisen
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Correspondence to Silvia Bordiga or Stian Svelle.

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Shearer, G.C., Forselv, S., Chavan, S. et al. In Situ Infrared Spectroscopic and Gravimetric Characterisation of the Solvent Removal and Dehydroxylation of the Metal Organic Frameworks UiO-66 and UiO-67. Top Catal 56, 770–782 (2013). https://doi.org/10.1007/s11244-013-0027-0

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  • DOI: https://doi.org/10.1007/s11244-013-0027-0

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