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5-{[4-(Di­methyl­amino)­phen­yl]ethyn­yl}pyrimidine–1,2,3,5-tetra­fluoro-4,6-di­iodo­benzene (1/2)

The treatment of 5-{[4-(di­methyl­amino)­phen­yl]ethyn­yl}pyrimidine with a threefold excess of 1,2,3,5-tetra­fluoro-4,6-di­iodo­benzene in di­chloro­methane solution led to the formation of the unexpected 1:2 title co-crystal, C(14)H(13)N(3)·2CF(4)I(2). In the extended structure, two unique C—I⋯N h...

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Detalles Bibliográficos
Autores principales: Bosch, Eric, Bowling, Nathan P.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9462022/
https://www.ncbi.nlm.nih.gov/pubmed/36337692
http://dx.doi.org/10.1107/S2414314622003807
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author Bosch, Eric
Bowling, Nathan P.
author_facet Bosch, Eric
Bowling, Nathan P.
author_sort Bosch, Eric
collection PubMed
description The treatment of 5-{[4-(di­methyl­amino)­phen­yl]ethyn­yl}pyrimidine with a threefold excess of 1,2,3,5-tetra­fluoro-4,6-di­iodo­benzene in di­chloro­methane solution led to the formation of the unexpected 1:2 title co-crystal, C(14)H(13)N(3)·2CF(4)I(2). In the extended structure, two unique C—I⋯N halogen bonds from one of the 1,2,3,5-tetra­fluoro-4,6-di­iodo­benzene mol­ecules to the pyrimidine N atoms of the 5-{[4-(di­methyl­amino)­phen­yl]ethyn­yl}pyrimidine mol­ecule generate [110] chains and layers of these chains are π-stacked along the a-axis direction. The second 1,2,3,5-tetra­fluoro-4,6-di­iodo­benzene mol­ecule resides in channels formed parallel to the a-axis direction between stacks of 5-{[4-(di­methyl­amino)­phen­yl]ethyn­yl}pyrimidine mol­ecules and inter­acts with them via C—I⋯π(alkyne) contacts. [Image: see text]
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spelling pubmed-94620222022-11-04 5-{[4-(Di­methyl­amino)­phen­yl]ethyn­yl}pyrimidine–1,2,3,5-tetra­fluoro-4,6-di­iodo­benzene (1/2) Bosch, Eric Bowling, Nathan P. IUCrdata Data Reports The treatment of 5-{[4-(di­methyl­amino)­phen­yl]ethyn­yl}pyrimidine with a threefold excess of 1,2,3,5-tetra­fluoro-4,6-di­iodo­benzene in di­chloro­methane solution led to the formation of the unexpected 1:2 title co-crystal, C(14)H(13)N(3)·2CF(4)I(2). In the extended structure, two unique C—I⋯N halogen bonds from one of the 1,2,3,5-tetra­fluoro-4,6-di­iodo­benzene mol­ecules to the pyrimidine N atoms of the 5-{[4-(di­methyl­amino)­phen­yl]ethyn­yl}pyrimidine mol­ecule generate [110] chains and layers of these chains are π-stacked along the a-axis direction. The second 1,2,3,5-tetra­fluoro-4,6-di­iodo­benzene mol­ecule resides in channels formed parallel to the a-axis direction between stacks of 5-{[4-(di­methyl­amino)­phen­yl]ethyn­yl}pyrimidine mol­ecules and inter­acts with them via C—I⋯π(alkyne) contacts. [Image: see text] International Union of Crystallography 2022-04-12 /pmc/articles/PMC9462022/ /pubmed/36337692 http://dx.doi.org/10.1107/S2414314622003807 Text en © Bosch and Bowling 2022 https://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.
spellingShingle Data Reports
Bosch, Eric
Bowling, Nathan P.
5-{[4-(Di­methyl­amino)­phen­yl]ethyn­yl}pyrimidine–1,2,3,5-tetra­fluoro-4,6-di­iodo­benzene (1/2)
title 5-{[4-(Di­methyl­amino)­phen­yl]ethyn­yl}pyrimidine–1,2,3,5-tetra­fluoro-4,6-di­iodo­benzene (1/2)
title_full 5-{[4-(Di­methyl­amino)­phen­yl]ethyn­yl}pyrimidine–1,2,3,5-tetra­fluoro-4,6-di­iodo­benzene (1/2)
title_fullStr 5-{[4-(Di­methyl­amino)­phen­yl]ethyn­yl}pyrimidine–1,2,3,5-tetra­fluoro-4,6-di­iodo­benzene (1/2)
title_full_unstemmed 5-{[4-(Di­methyl­amino)­phen­yl]ethyn­yl}pyrimidine–1,2,3,5-tetra­fluoro-4,6-di­iodo­benzene (1/2)
title_short 5-{[4-(Di­methyl­amino)­phen­yl]ethyn­yl}pyrimidine–1,2,3,5-tetra­fluoro-4,6-di­iodo­benzene (1/2)
title_sort 5-{[4-(di­methyl­amino)­phen­yl]ethyn­yl}pyrimidine–1,2,3,5-tetra­fluoro-4,6-di­iodo­benzene (1/2)
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9462022/
https://www.ncbi.nlm.nih.gov/pubmed/36337692
http://dx.doi.org/10.1107/S2414314622003807
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