Skip to main content
SpringerLink
Log in

Structure–Properties Relations in Werner β-[Ni(NCS)2(4-MePy)4] Clathrates. Part 2. Host–Host Interactions as a Function of the Guest Molecular Size and Shape and the Amount of Absorbed Guest Compound

  • Published:
Journal of inclusion phenomena and macrocyclic chemistry Aims and scope Submit manuscript

Abstract

Careful analysis of changes in the geometry of the host lattice structure on inclusion of different guest molecules was performed for 11 β-[Ni(NCS)2(4-methylpyridine)4] clathrates reported in the literature, and specific features were established for the geometry of the host crystal lattice structure, which are characteristic for different modes of location of the guest molecules. A new method is suggested for the analysis of the volume and shape of the empty space in clathrates. Experimental data are reported on the dependence of the a and c parameters of the unit cell of clathrate phases (with furan and dichloromethane as guest components) from the guest uptake. Consideration of these data permit us to construct a model of the changes of host–host interactions in the β-[Ni(NCS)2(4-methylpyridine)4] clathrates with change of guest uptakes. Modeling of the process of diffusion of the guest molecule through the channel of the β-[Ni(NCS)2(4-methylpyridine)4] clathrate allowed the nature of the rate-determining step of diffusion to be established. Part 1 of this series has been published as [3].

This is a preview of subscription content, log in via an institution to check access.

Access this article

Log in via an institution

Price excludes VAT (USA)
Tax calculation will be finalised during checkout.

Instant access to the full article PDF.

Institutional subscriptions

Similar content being viewed by others

References

  1. A. Yu. Manakov and J. Lipkowski: Thermochim. Acta 277, 199 (1996).

    Google Scholar 

  2. A. Yu. Manakov, J. Lipkowski, K. Suwinska and M. Kitamura: J. Incl. Phenom. 26, 1 (1996).

    Google Scholar 

  3. A. Yu. Manakov and J. Lipkowski: J. Incl. Phenom. 29, 41 (1997).

    Google Scholar 

  4. J. Lipkowski, K. Suwinska, G. D. andreetti and K. Stadnicka: J. Mol. Struct. 75, 101 (1981).

    Google Scholar 

  5. D. R. Bond, G. E. Jackson and L. R. Nassimbeni: S. Afr. J. Chem. 36, 19 (1983).

    Google Scholar 

  6. F. H. Allen, S. Bellard, M. D. Brice, B. A. Cartwright, A. Doubleday, H. Higgs, T. Hummelink, B. G. Hummelink-Peters, O. Kennard, W. D. S. Motherwell, X. Y. Rodgers and D. G. Watson: Acta Crystallogr. B35, 2331 (1979).

    Google Scholar 

  7. E. Rodulfo de Gil and I. S. Kerr: J. Appl. Crystallogr. 10, 315 (1977).

    Google Scholar 

  8. J. Lipkowski: in J. L. Atwood, J. E. D. Davies and D. D. MacNicol (eds.), Inclusion Compounds, Vol. 1, Academic Press, London (1984), pp. 59–103.

    Google Scholar 

  9. W. Kemula, J. Lipkowski and D. Sybilska: Roczn. Chem. 48, 3 (1974); Chem. Abstr. 80, 145198g (1974).

    Google Scholar 

  10. S. Motherwell: EENY June 1974, Potential Energy Program, University Chemical Laboratory, Cambrige (U.K.).

    Google Scholar 

  11. N. L. Allinger: J. Am. Chem. Soc. 99, 8127 (1977).

    Google Scholar 

  12. C. Rizzoli, V. Sangermano, C. Calestani and G. D. andreetti: CRYSRULER, Ver. 2.0, Universita Degli Studi di Parma (1989).

  13. G. M. Sheldrick: SHELXTL PC, Ver. 4.1. An Integrated System for Solving, Refining and Displaying Crystal Structure from Diffraction Data, Siemens Analytical X-Ray Instruments, Inc., Madison, Wisc. (1990).

    Google Scholar 

  14. Yu. V. Zefirov and P. M. Zorkij: Uspehi Khimii (Russian Chemical Reviews), 64, 446 (1995); Chem. Abstr. 124, 116354b (1996).

    Google Scholar 

  15. J. Lipkowski: J. Mol. Struct. 75, 13 (1981).

    Google Scholar 

  16. D. Soldatov, J. Lipkowski and E. Grachev: Zh. Struct. Khim. 36(5), 912 (1995); Chem. Abstr. 124, 132038g (1996).

    Google Scholar 

  17. L. Pang, E. A. C. Lucken and G. Bernardinelli: J. Incl. Phenom. 13, 63 (1992).

    Google Scholar 

  18. L. Lavelle and L. R. Nassimbeni: J. Incl. Phenom. 16, 25 (1993).

    Google Scholar 

  19. A. I. Kitaigorodsky: Molecular Crystals and Molecules, Part 1, Academic Press, New York (1973).

    Google Scholar 

  20. G. M. Sheldrick: SHELX 93, Program for the Refinement of Crystal Structures, University of Gottingen, Germany (1993).

    Google Scholar 

  21. J. Lipkowski and S. Majchrzak: Roczn Chem. 49, 1655 (1975); Chem. Abstr. 84, 11139n (1976).

    Google Scholar 

  22. J. Lipkowski, A. Zelenkiewicz, J. Hatt and W. Zelenkiewicz: J. Incl. Phenom. 7, 511 (1989).

    Google Scholar 

  23. J. Lipkowski, P. Starzewski and W. Zelenkiewicz: Polish J. Chem. 56, 349 (1982).

    Google Scholar 

  24. M. Sitarski and J. Lipkowski: Roczn. Chem. 50, 1129 (1976); Chem. Abstr. 85, 149413z (1976).

    Google Scholar 

Download references

Author information

Authors and Affiliations

  1. Institute of Physical Chemistry, Polish Academy of Sciences, Kasprzaka 44/52, 01 224, Warsaw, Poland

    A. Yu. Manakov, J. Lipkowski & J. Pielaszek

Authors
  1. A. Yu. Manakov
    View author publications

    You can also search for this author in PubMed Google Scholar

  2. J. Lipkowski
    View author publications

    You can also search for this author in PubMed Google Scholar

  3. J. Pielaszek
    View author publications

    You can also search for this author in PubMed Google Scholar

Rights and permissions

Reprints and permissions

About this article

Cite this article

Manakov, A.Y., Lipkowski, J. & Pielaszek, J. Structure–Properties Relations in Werner β-[Ni(NCS)2(4-MePy)4] Clathrates. Part 2. Host–Host Interactions as a Function of the Guest Molecular Size and Shape and the Amount of Absorbed Guest Compound. Journal of Inclusion Phenomena 35, 531–548 (1999). https://doi.org/10.1023/A:1008068825957

Download citation

  • Issue Date:

  • DOI: https://doi.org/10.1023/A:1008068825957

Search

Navigation