Crystal structure of 4-bromo-2-[(E)-N-(2,2,6,6-tetra­methyl­piperidin-4-yl)carboximido­yl]phenol dihydrate

In the title hydrate, C(16)H(23)BrN(2)O·2H(2)O, the organic mol­ecule features a strong intra­molecular O—H⋯N hydrogen bond. The piperidine ring, in addition, adopts a chair conformation with the exocyclic C—N bond in an equatorial orientation. The water molecules of crystallization are disordered (...

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Autores principales: Mague, Joel T., Mohamed, Shaaban K., Akkurt, Mehmet, Abdelhamid, Antar A., Albayati, Mustafa R.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
Data Reports
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4420100/
https://www.ncbi.nlm.nih.gov/pubmed/25995942
http://dx.doi.org/10.1107/S2056989015007471
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author Mague, Joel T.
Mohamed, Shaaban K.
Akkurt, Mehmet
Abdelhamid, Antar A.
Albayati, Mustafa R.
author_facet Mague, Joel T.
Mohamed, Shaaban K.
Akkurt, Mehmet
Abdelhamid, Antar A.
Albayati, Mustafa R.
author_sort Mague, Joel T.
collection PubMed
description In the title hydrate, C(16)H(23)BrN(2)O·2H(2)O, the organic mol­ecule features a strong intra­molecular O—H⋯N hydrogen bond. The piperidine ring, in addition, adopts a chair conformation with the exocyclic C—N bond in an equatorial orientation. The water molecules of crystallization are disordered (each over two sets of sites with half occupancy. In the crystal, they associate into corrugated (100) sheets of (H(2)O)(4) tetra­mers linked by O—H⋯O hydrogen bonds. The organic mol­ecules, in turn, are arranged at both sides of these sheets, linked by water–piperidine O—H⋯N hydrogen bonds.
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spelling pubmed-44201002015-05-20 Crystal structure of 4-bromo-2-[(E)-N-(2,2,6,6-tetra­methyl­piperidin-4-yl)carboximido­yl]phenol dihydrate Mague, Joel T. Mohamed, Shaaban K. Akkurt, Mehmet Abdelhamid, Antar A. Albayati, Mustafa R. Acta Crystallogr E Crystallogr Commun Data Reports In the title hydrate, C(16)H(23)BrN(2)O·2H(2)O, the organic mol­ecule features a strong intra­molecular O—H⋯N hydrogen bond. The piperidine ring, in addition, adopts a chair conformation with the exocyclic C—N bond in an equatorial orientation. The water molecules of crystallization are disordered (each over two sets of sites with half occupancy. In the crystal, they associate into corrugated (100) sheets of (H(2)O)(4) tetra­mers linked by O—H⋯O hydrogen bonds. The organic mol­ecules, in turn, are arranged at both sides of these sheets, linked by water–piperidine O—H⋯N hydrogen bonds. International Union of Crystallography 2015-04-25 /pmc/articles/PMC4420100/ /pubmed/25995942 http://dx.doi.org/10.1107/S2056989015007471 Text en © Mague et al. 2015 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Data Reports
Mague, Joel T.
Mohamed, Shaaban K.
Akkurt, Mehmet
Abdelhamid, Antar A.
Albayati, Mustafa R.
Crystal structure of 4-bromo-2-[(E)-N-(2,2,6,6-tetra­methyl­piperidin-4-yl)carboximido­yl]phenol dihydrate
title Crystal structure of 4-bromo-2-[(E)-N-(2,2,6,6-tetra­methyl­piperidin-4-yl)carboximido­yl]phenol dihydrate
title_full Crystal structure of 4-bromo-2-[(E)-N-(2,2,6,6-tetra­methyl­piperidin-4-yl)carboximido­yl]phenol dihydrate
title_fullStr Crystal structure of 4-bromo-2-[(E)-N-(2,2,6,6-tetra­methyl­piperidin-4-yl)carboximido­yl]phenol dihydrate
title_full_unstemmed Crystal structure of 4-bromo-2-[(E)-N-(2,2,6,6-tetra­methyl­piperidin-4-yl)carboximido­yl]phenol dihydrate
title_short Crystal structure of 4-bromo-2-[(E)-N-(2,2,6,6-tetra­methyl­piperidin-4-yl)carboximido­yl]phenol dihydrate
title_sort crystal structure of 4-bromo-2-[(e)-n-(2,2,6,6-tetra­methyl­piperidin-4-yl)carboximido­yl]phenol dihydrate
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4420100/
https://www.ncbi.nlm.nih.gov/pubmed/25995942
http://dx.doi.org/10.1107/S2056989015007471
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