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Crystal structure of a two-dimensional metal–organic framework assembled from lithium(I) and γ-cyclo­dextrin

The crystal structure of the polymeric title compound, catena-poly[[[di­aqua­lithium]-μ-γ-cyclo­dextrin(1−)-[aqua­lithium]-μ-γ-cyclo­dextrin(1−)] pentadecahydrate], {[Li(2)(C(48)H(79)O(40))(2)(H(2)O)(3)]·15H(2)O}(n), consists of deprotonated γ-cyclo­dextrin (CD) mol­ecules assembled by lithium ions...

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Autores principales: Krukle-Berzina, Kristine, Belyakov, Sergey, Mishnev, Anatoly, Shubin, Kirill
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7057359/
https://www.ncbi.nlm.nih.gov/pubmed/32148874
http://dx.doi.org/10.1107/S2056989020001942
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author Krukle-Berzina, Kristine
Belyakov, Sergey
Mishnev, Anatoly
Shubin, Kirill
author_facet Krukle-Berzina, Kristine
Belyakov, Sergey
Mishnev, Anatoly
Shubin, Kirill
author_sort Krukle-Berzina, Kristine
collection PubMed
description The crystal structure of the polymeric title compound, catena-poly[[[di­aqua­lithium]-μ-γ-cyclo­dextrin(1−)-[aqua­lithium]-μ-γ-cyclo­dextrin(1−)] pentadecahydrate], {[Li(2)(C(48)H(79)O(40))(2)(H(2)O)(3)]·15H(2)O}(n), consists of deprotonated γ-cyclo­dextrin (CD) mol­ecules assembled by lithium ions into metal–organic ribbons that are cross-linked by multiple O—H⋯O hydrogen bonds into sheets extending parallel to (0[Image: see text]1). Within a ribbon, one Li(+) ion is coordinated by one deprotonated hydroxyl group of the first γ-CD torus and by one hydroxyl group of the second γ-CD torus as well as by two water mol­ecules. The other Li(+) ion is coordinated by one deprotonated hydroxyl and by one hydroxyl group of the second γ-CD torus, by one hydroxyl group of the first γ-CD torus as well as by one water mol­ecule. The coordination spheres of both Li(+) cations are distorted tetra­hedral. The packing of the structure constitute channels along the a axis. Parts of the hy­droxy­methyl groups in cyclo­dextrin molecules as well as water mol­ecules show two-component disorder. Electron density associated with additional disordered solvent mol­ecules inside the cavities was removed with the SQUEEZE [Spek (2015 ▸). Acta Cryst. C71, 9–18] routine in PLATON. These solvent mol­ecules are not considered in the given chemical formula and other crystal data. Five out of the sixteen hy­droxy­methyl groups and one water mol­ecule are disordered over two sets of sites.
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spelling pubmed-70573592020-03-06 Crystal structure of a two-dimensional metal–organic framework assembled from lithium(I) and γ-cyclo­dextrin Krukle-Berzina, Kristine Belyakov, Sergey Mishnev, Anatoly Shubin, Kirill Acta Crystallogr E Crystallogr Commun Research Communications The crystal structure of the polymeric title compound, catena-poly[[[di­aqua­lithium]-μ-γ-cyclo­dextrin(1−)-[aqua­lithium]-μ-γ-cyclo­dextrin(1−)] pentadecahydrate], {[Li(2)(C(48)H(79)O(40))(2)(H(2)O)(3)]·15H(2)O}(n), consists of deprotonated γ-cyclo­dextrin (CD) mol­ecules assembled by lithium ions into metal–organic ribbons that are cross-linked by multiple O—H⋯O hydrogen bonds into sheets extending parallel to (0[Image: see text]1). Within a ribbon, one Li(+) ion is coordinated by one deprotonated hydroxyl group of the first γ-CD torus and by one hydroxyl group of the second γ-CD torus as well as by two water mol­ecules. The other Li(+) ion is coordinated by one deprotonated hydroxyl and by one hydroxyl group of the second γ-CD torus, by one hydroxyl group of the first γ-CD torus as well as by one water mol­ecule. The coordination spheres of both Li(+) cations are distorted tetra­hedral. The packing of the structure constitute channels along the a axis. Parts of the hy­droxy­methyl groups in cyclo­dextrin molecules as well as water mol­ecules show two-component disorder. Electron density associated with additional disordered solvent mol­ecules inside the cavities was removed with the SQUEEZE [Spek (2015 ▸). Acta Cryst. C71, 9–18] routine in PLATON. These solvent mol­ecules are not considered in the given chemical formula and other crystal data. Five out of the sixteen hy­droxy­methyl groups and one water mol­ecule are disordered over two sets of sites. International Union of Crystallography 2020-02-14 /pmc/articles/PMC7057359/ /pubmed/32148874 http://dx.doi.org/10.1107/S2056989020001942 Text en © Krukle-Berzina et al. 2020 http://creativecommons.org/licenses/by/4.0/ This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.http://creativecommons.org/licenses/by/4.0/
spellingShingle Research Communications
Krukle-Berzina, Kristine
Belyakov, Sergey
Mishnev, Anatoly
Shubin, Kirill
Crystal structure of a two-dimensional metal–organic framework assembled from lithium(I) and γ-cyclo­dextrin
title Crystal structure of a two-dimensional metal–organic framework assembled from lithium(I) and γ-cyclo­dextrin
title_full Crystal structure of a two-dimensional metal–organic framework assembled from lithium(I) and γ-cyclo­dextrin
title_fullStr Crystal structure of a two-dimensional metal–organic framework assembled from lithium(I) and γ-cyclo­dextrin
title_full_unstemmed Crystal structure of a two-dimensional metal–organic framework assembled from lithium(I) and γ-cyclo­dextrin
title_short Crystal structure of a two-dimensional metal–organic framework assembled from lithium(I) and γ-cyclo­dextrin
title_sort crystal structure of a two-dimensional metal–organic framework assembled from lithium(i) and γ-cyclo­dextrin
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7057359/
https://www.ncbi.nlm.nih.gov/pubmed/32148874
http://dx.doi.org/10.1107/S2056989020001942
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