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The Role of Lattice Matching Techniques in the Characterization of Polymorphic Forms

An inspection of the recent literature reveals that polymorphism is a frequently encountered phenomenon. The recognition of polymorphic forms plays a vital role in the materials sciences because such structures are characterized by different crystal packing and accordingly have different physical pr...

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Autor principal: Mighell, Alan D.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: [Gaithersburg, MD] : U.S. Dept. of Commerce, National Institute of Standards and Technology 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4550339/
https://www.ncbi.nlm.nih.gov/pubmed/26989586
http://dx.doi.org/10.6028/jres.116.007
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author Mighell, Alan D.
author_facet Mighell, Alan D.
author_sort Mighell, Alan D.
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description An inspection of the recent literature reveals that polymorphism is a frequently encountered phenomenon. The recognition of polymorphic forms plays a vital role in the materials sciences because such structures are characterized by different crystal packing and accordingly have different physical properties. In the pharmaceutical industry, recognition of polymorphic forms can be critical for, in certain cases, a polymorphic form of a drug may be an ineffective therapeutic agent due to its unfavorable physical properties. A check of the recent literature has revealed that in some cases new polymorphic forms are not recognized. In other instances, a supposedly new polymeric form is actually the result of an incorrect structure determination. Fortunately, lattice-matching techniques, which have proved invaluable in the identification and characterization of crystal structures, represent a powerful tool for analyzing polymorphic forms. These lattice-matching methods are based on either of two strategies: (a) the reduced cell strategy–the matching of reduced cells of the respective lattices or (b) the matrix strategy–the determination of a matrix or matrices relating the two lattices coupled with an analysis of the matrix elements. Herein, these techniques are applied to three typical cases–(a) the identification of a new polymorphic form, (b) the demonstration that a substance may not be a new polymorphic form due to missed symmetry, and (c) the evaluation of pseudo polymorphism because of a missed lattice. To identify new polymorphic forms and to prevent errors, it is recommended that these lattice matching techniques become an integral part of the editorial review process of crystallography journals.
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spelling pubmed-45503392016-03-17 The Role of Lattice Matching Techniques in the Characterization of Polymorphic Forms Mighell, Alan D. J Res Natl Inst Stand Technol Article An inspection of the recent literature reveals that polymorphism is a frequently encountered phenomenon. The recognition of polymorphic forms plays a vital role in the materials sciences because such structures are characterized by different crystal packing and accordingly have different physical properties. In the pharmaceutical industry, recognition of polymorphic forms can be critical for, in certain cases, a polymorphic form of a drug may be an ineffective therapeutic agent due to its unfavorable physical properties. A check of the recent literature has revealed that in some cases new polymorphic forms are not recognized. In other instances, a supposedly new polymeric form is actually the result of an incorrect structure determination. Fortunately, lattice-matching techniques, which have proved invaluable in the identification and characterization of crystal structures, represent a powerful tool for analyzing polymorphic forms. These lattice-matching methods are based on either of two strategies: (a) the reduced cell strategy–the matching of reduced cells of the respective lattices or (b) the matrix strategy–the determination of a matrix or matrices relating the two lattices coupled with an analysis of the matrix elements. Herein, these techniques are applied to three typical cases–(a) the identification of a new polymorphic form, (b) the demonstration that a substance may not be a new polymorphic form due to missed symmetry, and (c) the evaluation of pseudo polymorphism because of a missed lattice. To identify new polymorphic forms and to prevent errors, it is recommended that these lattice matching techniques become an integral part of the editorial review process of crystallography journals. [Gaithersburg, MD] : U.S. Dept. of Commerce, National Institute of Standards and Technology 2011 2011-04-01 /pmc/articles/PMC4550339/ /pubmed/26989586 http://dx.doi.org/10.6028/jres.116.007 Text en https://creativecommons.org/publicdomain/zero/1.0/ The Journal of Research of the National Institute of Standards and Technology is a publication of the U.S. Government. The papers are in the public domain and are not subject to copyright in the United States. Articles from J Res may contain photographs or illustrations copyrighted by other commercial organizations or individuals that may not be used without obtaining prior approval from the holder of the copyright.
spellingShingle Article
Mighell, Alan D.
The Role of Lattice Matching Techniques in the Characterization of Polymorphic Forms
title The Role of Lattice Matching Techniques in the Characterization of Polymorphic Forms
title_full The Role of Lattice Matching Techniques in the Characterization of Polymorphic Forms
title_fullStr The Role of Lattice Matching Techniques in the Characterization of Polymorphic Forms
title_full_unstemmed The Role of Lattice Matching Techniques in the Characterization of Polymorphic Forms
title_short The Role of Lattice Matching Techniques in the Characterization of Polymorphic Forms
title_sort role of lattice matching techniques in the characterization of polymorphic forms
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4550339/
https://www.ncbi.nlm.nih.gov/pubmed/26989586
http://dx.doi.org/10.6028/jres.116.007
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