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Crystal structure of 2,3,5,6-tetra­kis­(pyridin-2-yl)pyrazine hydrogen peroxide 4.75-solvate

The structure of the title co-crystal, C(24)H(16)N(6)·4.75H(2)O(2), consists of a 2,3,5,6-tetra­kis­(pyridin-2-yl)pyrazine coformer and hydrogen peroxide solvent mol­ecules in an overall ratio of 1:4.75. Three of the six H(2)O(2) mol­ecules modelled in the structure were found to be cross-orientatio...

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Autores principales: Navasardyan, Mger A., Bezzubov, Stanislav I., Kuz’mina, Lyudmila G., Prikhodchenko, Petr V., Churakov, Andrei V.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2017
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5683516/
https://www.ncbi.nlm.nih.gov/pubmed/29152376
http://dx.doi.org/10.1107/S2056989017015328
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author Navasardyan, Mger A.
Bezzubov, Stanislav I.
Kuz’mina, Lyudmila G.
Prikhodchenko, Petr V.
Churakov, Andrei V.
author_facet Navasardyan, Mger A.
Bezzubov, Stanislav I.
Kuz’mina, Lyudmila G.
Prikhodchenko, Petr V.
Churakov, Andrei V.
author_sort Navasardyan, Mger A.
collection PubMed
description The structure of the title co-crystal, C(24)H(16)N(6)·4.75H(2)O(2), consists of a 2,3,5,6-tetra­kis­(pyridin-2-yl)pyrazine coformer and hydrogen peroxide solvent mol­ecules in an overall ratio of 1:4.75. Three of the six H(2)O(2) mol­ecules modelled in the structure were found to be cross-orientationally disordered over two positions with occupancy ratios 0.846 (9):0.154 (9), 0.75 (2):0.25 (2), and 0.891 (9):0.109 (9). In the crystal, all of the peroxide mol­ecules are linked into hydrogen-bonded chains that propagate parallel to the a axis. These chains are further linked by O—H⋯N hydrogen bonds to the pyridine groups of the main mol­ecule.
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spelling pubmed-56835162017-11-17 Crystal structure of 2,3,5,6-tetra­kis­(pyridin-2-yl)pyrazine hydrogen peroxide 4.75-solvate Navasardyan, Mger A. Bezzubov, Stanislav I. Kuz’mina, Lyudmila G. Prikhodchenko, Petr V. Churakov, Andrei V. Acta Crystallogr E Crystallogr Commun Research Communications The structure of the title co-crystal, C(24)H(16)N(6)·4.75H(2)O(2), consists of a 2,3,5,6-tetra­kis­(pyridin-2-yl)pyrazine coformer and hydrogen peroxide solvent mol­ecules in an overall ratio of 1:4.75. Three of the six H(2)O(2) mol­ecules modelled in the structure were found to be cross-orientationally disordered over two positions with occupancy ratios 0.846 (9):0.154 (9), 0.75 (2):0.25 (2), and 0.891 (9):0.109 (9). In the crystal, all of the peroxide mol­ecules are linked into hydrogen-bonded chains that propagate parallel to the a axis. These chains are further linked by O—H⋯N hydrogen bonds to the pyridine groups of the main mol­ecule. International Union of Crystallography 2017-10-31 /pmc/articles/PMC5683516/ /pubmed/29152376 http://dx.doi.org/10.1107/S2056989017015328 Text en © Navasardyan et al. 2017 http://creativecommons.org/licenses/by/2.0/uk/ 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/2.0/uk/
spellingShingle Research Communications
Navasardyan, Mger A.
Bezzubov, Stanislav I.
Kuz’mina, Lyudmila G.
Prikhodchenko, Petr V.
Churakov, Andrei V.
Crystal structure of 2,3,5,6-tetra­kis­(pyridin-2-yl)pyrazine hydrogen peroxide 4.75-solvate
title Crystal structure of 2,3,5,6-tetra­kis­(pyridin-2-yl)pyrazine hydrogen peroxide 4.75-solvate
title_full Crystal structure of 2,3,5,6-tetra­kis­(pyridin-2-yl)pyrazine hydrogen peroxide 4.75-solvate
title_fullStr Crystal structure of 2,3,5,6-tetra­kis­(pyridin-2-yl)pyrazine hydrogen peroxide 4.75-solvate
title_full_unstemmed Crystal structure of 2,3,5,6-tetra­kis­(pyridin-2-yl)pyrazine hydrogen peroxide 4.75-solvate
title_short Crystal structure of 2,3,5,6-tetra­kis­(pyridin-2-yl)pyrazine hydrogen peroxide 4.75-solvate
title_sort crystal structure of 2,3,5,6-tetra­kis­(pyridin-2-yl)pyrazine hydrogen peroxide 4.75-solvate
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5683516/
https://www.ncbi.nlm.nih.gov/pubmed/29152376
http://dx.doi.org/10.1107/S2056989017015328
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