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NQR investigation and characterization of cocrystals and crystal polymorphs

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Abstract

The application of 14N NQR to the study of cocrystals and crystal polymorphs is reviewed. In ferroelectric and antiferroelectric organic cocrystals 14N NQR is used to determine proton position in an N-H...O hydrogen bond and proton displacement below TC. In cocrystal isonicitinamide – oxalic acid (2:1) 14N NQR is used to distinguish between two polymorphs and to determine the type of the hydrogen bond (N−...H-O). The difference in the 14N NQR spectra of cocrystal formers and cocrystal is investigated in case of carbamazepine, saccharin and carbamazepine - saccharin (1:1). The experimental resolution allows an unambiguous distinction between the 14N NQR spectrum of the cocrystal and the 14N NQR spectra of the cocrystal formers. The possibility of application of NQR and double resonance for the determination of the inhomogeneity of the sample and for the study of the life time of an unstable polymorph is discussed.

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References

  1. Horiuchi, S., Ishii, F., Kumai, R., Okimoto, Y., Tachibana, H., Nagaosa, N., Tokura, Y.: Nat. Mater. 4, 163 (2005)

    Article  ADS  Google Scholar 

  2. Horiuchi, S., Tokura, Y.: Organic ferroelectrics. Nat. Mater. 7, 357 (2008)

    Article  ADS  Google Scholar 

  3. Horiuchi, S., Kumai, R., Tokura, Y.: J. Am. Chem. Soc. 127, 5010 (2005)

    Article  Google Scholar 

  4. Horiuchi, S., Kumai, R., Tokura, Y.: Angew. Chem. Int. Ed. 46, 3497 (2007)

    Article  Google Scholar 

  5. Horiuchi, S., Hasegawa, T., Tokura, Y.: Mol. Cryst. Liq. Cryst. 455, 295 (2006)

    Article  Google Scholar 

  6. Horiuchi, S., Hasegawa, T., Tokura, Y.: J. Phys. Soc. Jpn. 75, 051016 (2006)

    Article  ADS  Google Scholar 

  7. Nanjwade, V.K., Manvi, F.V., Ali, S.M., Nanjwade, B.K., Maste, M.M.: J. App. Pharm. Sci. 1(08), 01–05 (2011)

    Google Scholar 

  8. Schultheiss, N., Newman, A.: Cryst. Growth Des. 9, 2950–2967 (2009)

    Article  Google Scholar 

  9. Seliger, J.: Nuclear quadrupole resonance: theory. In: Lindon, J.C., Tranter, G.E., Holmes, J.L. (eds.) Encyclopedia of Spectroscopy and Spectrometry, pp. 1672–1680. Academic Press, San Diego etc. (2000)

    Google Scholar 

  10. Seliger, J.: Acta Chim. Slov. 58, 471–477 (2011)

    Google Scholar 

  11. Seliger, J., Žagar, V.: J. Magn. Reson. 193, 54–62 (2008)

    Article  ADS  Google Scholar 

  12. Blinc, R., Mali, M., Osredkar, R., Prelesnik, A., Seliger, J., Zupancic, I., Ehrenberg, L.: J. Chem. Phys. 57, 5087–5093 (1972)

    Article  ADS  Google Scholar 

  13. Edmonds, D.T.: Phys. Rep. 29, 234–290 (1977)

    Article  ADS  Google Scholar 

  14. Seliger, J., Žagar, V., Blinc, R.: J. Magn. Reson. A 106, 214–222 (1994)

    Article  Google Scholar 

  15. Seliger, J., Žagar, V., Blinc, R.: Z. Naturforsch. A 49, 31–34 (1994)

    Google Scholar 

  16. Seliger, J., Osredkar, R., Mali, M., Blinc, R.: J. Chem. Phys. 65, 2887–2891 (1976)

    Article  ADS  Google Scholar 

  17. Seliger, J., Blinc, R., Arend, H., Kind, R.: Z. Phys. B 25, 189–195 (1976)

    Article  ADS  Google Scholar 

  18. Stephenson, D., Smith, J.A.S.: Proc. Roy. Soc. A 416, 149–178 (1988)

    Article  ADS  Google Scholar 

  19. Seliger, J., Žagar, V.: J. Magn. Reson. 199, 199–207 (2009)

    Article  ADS  Google Scholar 

  20. Seliger, J., Žagar, V.: Appl. Magn. Reson. (2012). doi:10.1007/s00723-011-0303-8

  21. Gotoh, K., Asaji, T., Ishida, H.: Acta Cryst. C63, o17–o20 (2007)

    Google Scholar 

  22. Kumai, R., Horiuchi, S., Okimoto, Y., Tokura, Y.: J. Chem. Phys. 125, 084715 (2006)

    Article  ADS  Google Scholar 

  23. Asaji, T., Seliger, J., Žagar, V., Sekiguchi, M., Watanabe, J., Gotoh, K., Ishida, H., Vrtnik, S., Dolinšek, J.: J. Phys. Condens. Matter. 19, 226203 (2007)

    Article  ADS  Google Scholar 

  24. Seliger, J., Žagar, V., Asaji, T., Gotoh, K., Ishida, H.: Phys. Chem. Chem. Phys. 13, 9165–9172 (2011)

    Article  Google Scholar 

  25. Seliger, J.: Acta Chim. Slov. 58, 471–477 (2011)

    Google Scholar 

  26. Schmidtmann, M., Farrugia, L.J., Middlemiss, D.S., Gutmann, M.J., McIntyre, G.J., Wilson, C.C.: J. Phys. Chem. A 113, 13985–13997 (2009)

    Article  Google Scholar 

  27. Vishweshwar, P., Nangia, A., Lynch, V.M.: Cryst. Growth Des. 3, 783–790 (2003)

    Article  Google Scholar 

  28. Seliger, J., Žagar, V.: J. Phys. Chem. A 114, 12083–12087 (2010)

    Article  Google Scholar 

  29. Lang, M., Kampf, J., Matzger, A. J. : J. Pharm. Sci. 91, 1186–1190 (2002) and the references cited therein

    Article  Google Scholar 

  30. Okaya, Y.: Acta Cryst. B25, 2257–2263 (1969)

    Google Scholar 

  31. Porter III, W.W., Elie, S.C., Matzger, A.J.: Cryst. Growth Des. 8, 14–16 (2008)

    Article  Google Scholar 

  32. Fleischman, S.G., Kuduva, S.S., McMahon, J.A., Moulton, B., Bailey Walsh, R.D., Rodríguez-Hornedo, N., Zaworotko, M.: Cryst. Growth Des. 3, 909–919 (2003)

    Article  Google Scholar 

  33. Seliger, J., Žagar, V. (2012). doi:10.1016/j.ssnmr.2012.09.001

  34. Blinc, R., Seliger, J., Zidanšek, A., Žagar, V., Milia, F., Robert, H.: Solid State Nuclear Magn. Reson. 30, 61–68 (2006)

    Article  Google Scholar 

  35. Seliger, J., Žagar, V., Blinc, R.: Phys. Rev. B 47, 14753–14756 (1993)

    Article  ADS  Google Scholar 

Download references

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Authors and Affiliations

  1. Jozef Stefan Institute, Jamova 39, 1000, Ljubljana, Slovenia

    Janez Seliger & Veselko Žagar

  2. Faculty of Mathematics and Physics, University of Ljubljana, Jadranska 19, 1000, Ljubljana, Slovenia

    Janez Seliger

  3. EN-FIST Centre of Excellence, Dunajska 156, 1000, Ljubljana, Slovenia

    Janez Seliger

  4. Department of Chemistry, College of Humanities and Sciences, Nihon University, Sakurajosui 3-25-40, Setagaya-ku, Tokyo, 156-8550, Japan

    Tetsuo Asaji

Authors
  1. Janez Seliger
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  2. Veselko Žagar
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  3. Tetsuo Asaji
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Correspondence to Janez Seliger.

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Seliger, J., Žagar, V. & Asaji, T. NQR investigation and characterization of cocrystals and crystal polymorphs. Hyperfine Interact 222, 1–13 (2013). https://doi.org/10.1007/s10751-012-0665-9

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