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The low-temperature phase of morpholinium tetra­fluoro­borate

The crystal structure of the low-temperature form of the title compound, C(4)H(10)NO(+)·BF(4) (−), was determined at 80 K. Two reversible phase transitions, at 158/158 and 124/126 K (heating/cooling), were detected by differential scanning calorimetry for this compound, and the sequence of phase tra...

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Autores principales: Owczarek, Magdalena, Szklarz, Przemyslaw, Jakubas, Ryszard, Lis, Tadeusz
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961037/
https://www.ncbi.nlm.nih.gov/pubmed/21202061
http://dx.doi.org/10.1107/S1600536808004339
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author Owczarek, Magdalena
Szklarz, Przemyslaw
Jakubas, Ryszard
Lis, Tadeusz
author_facet Owczarek, Magdalena
Szklarz, Przemyslaw
Jakubas, Ryszard
Lis, Tadeusz
author_sort Owczarek, Magdalena
collection PubMed
description The crystal structure of the low-temperature form of the title compound, C(4)H(10)NO(+)·BF(4) (−), was determined at 80 K. Two reversible phase transitions, at 158/158 and 124/126 K (heating/cooling), were detected by differential scanning calorimetry for this compound, and the sequence of phase transitions was subsequently confirmed by single-crystal X-ray diffraction experiments. The asymmetric unit at 80 K consists of three BF(4) (−) tetra­hedral anions and three morpholinium cations (Z′ = 3). Hydrogen-bonded morpholinium cations form chains along the [100] direction. The BF(4) (−) anions are connected to these chains by N—H⋯F hydrogen bonds. In the crystal structure, two different layers perpendicular to the [001] direction can be distinguished, which differ in the geometry of the hydrogen bonds between cationic and anionic species.
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spelling pubmed-29610372010-12-30 The low-temperature phase of morpholinium tetra­fluoro­borate Owczarek, Magdalena Szklarz, Przemyslaw Jakubas, Ryszard Lis, Tadeusz Acta Crystallogr Sect E Struct Rep Online Organic Papers The crystal structure of the low-temperature form of the title compound, C(4)H(10)NO(+)·BF(4) (−), was determined at 80 K. Two reversible phase transitions, at 158/158 and 124/126 K (heating/cooling), were detected by differential scanning calorimetry for this compound, and the sequence of phase transitions was subsequently confirmed by single-crystal X-ray diffraction experiments. The asymmetric unit at 80 K consists of three BF(4) (−) tetra­hedral anions and three morpholinium cations (Z′ = 3). Hydrogen-bonded morpholinium cations form chains along the [100] direction. The BF(4) (−) anions are connected to these chains by N—H⋯F hydrogen bonds. In the crystal structure, two different layers perpendicular to the [001] direction can be distinguished, which differ in the geometry of the hydrogen bonds between cationic and anionic species. International Union of Crystallography 2008-03-05 /pmc/articles/PMC2961037/ /pubmed/21202061 http://dx.doi.org/10.1107/S1600536808004339 Text en © Owczarek et al. 2008 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 Organic Papers
Owczarek, Magdalena
Szklarz, Przemyslaw
Jakubas, Ryszard
Lis, Tadeusz
The low-temperature phase of morpholinium tetra­fluoro­borate
title The low-temperature phase of morpholinium tetra­fluoro­borate
title_full The low-temperature phase of morpholinium tetra­fluoro­borate
title_fullStr The low-temperature phase of morpholinium tetra­fluoro­borate
title_full_unstemmed The low-temperature phase of morpholinium tetra­fluoro­borate
title_short The low-temperature phase of morpholinium tetra­fluoro­borate
title_sort low-temperature phase of morpholinium tetra­fluoro­borate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961037/
https://www.ncbi.nlm.nih.gov/pubmed/21202061
http://dx.doi.org/10.1107/S1600536808004339
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