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Experimental and theoretical study on the complexation of the cesium cation with dibenzo-30-crown-10

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Abstract

From extraction experiments and γ-activity measurements, the extraction constant corresponding to the equilibrium Cs+ (aq) + A− (aq) + 1(nb) \( \rightleftarrows \) 1·Cs+(nb) + A−(nb) taking place in the two-phase water–nitrobenzene system (A− = picrate, 1 = dibenzo-30-crown-10; aq = aqueous phase, nb = nitrobenzene phase) was evaluated as log K ex (1·Cs+, A−) = 4.0 ± 0.1. Further, the stability constant of the 1·Cs+ complex in nitrobenzene saturated with water was calculated for a temperature of 25 °C: log β nb (1·Cs+) = 5.9 ± 0.1. Finally, by using quantum–mechanical DFT calculations, the most probable structure of the resulting cationic complex species 1·Cs+ was derived.

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Acknowledgments

This work was supported by the Grant Agency of Faculty of Environmental Sciences, Czech University of Life Sciences, Prague, Project No.: 42900/1312/3114 “Environmental Aspects of Sustainable Development of Society,” by the Czech Ministry of Education, Youth and Sports (Project MSM 6046137307) and by the Czech Science Foundation (Project P 205/10/2280). The computer time at the MetaCentrum (Project LM 2010005), as well as at the Institute of Physics (computer Luna/Apollo), Academy of Sciences of the Czech Republic, is gratefully acknowledged.

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Authors and Affiliations

  1. Faculty of Environmental Sciences, Czech University of Life Sciences, Prague, Kamýcká 129, 165 21, Prague 6, Czech Republic

    E. Makrlík

  2. Institute of Macromolecular Chemistry, Academy of Sciences of the Czech Republic, Heyrovského sq. 2, 162 06, Prague 6, Czech Republic

    P. Toman

  3. Department of Analytical Chemistry, Institute of Chemical Technology, Prague, Technická 5, 166 28, Prague 6, Czech Republic

    P. Vaňura

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  1. E. Makrlík
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  2. P. Toman
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  3. P. Vaňura
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Correspondence to E. Makrlík.

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Makrlík, E., Toman, P. & Vaňura, P. Experimental and theoretical study on the complexation of the cesium cation with dibenzo-30-crown-10. J Radioanal Nucl Chem 292, 1137–1140 (2012). https://doi.org/10.1007/s10967-011-1598-5

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  • DOI: https://doi.org/10.1007/s10967-011-1598-5

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