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Tris(2-carbamoylguanidinium) hydrogen fluorophosphonate fluorophosphonate monohydrate
The title structure, 3C(2)H(7)N(4)O(+)·HFPO(3) (−)·FPO(3) (2−)·H(2)O, contains three independent 2-carbamoylguanidinium cations, one fluorophosphonate, one hydrogen fluorophosphonate and one water molecule. There are three different layers in the structure that are nearly perpendicular to the c...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2011
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3254407/ https://www.ncbi.nlm.nih.gov/pubmed/22259550 http://dx.doi.org/10.1107/S1600536811051683 |
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author | Fábry, Jan Fridrichová, Michaela Dušek, Michal Fejfarová, Karla Krupková, Radmila |
author_facet | Fábry, Jan Fridrichová, Michaela Dušek, Michal Fejfarová, Karla Krupková, Radmila |
author_sort | Fábry, Jan |
collection | PubMed |
description | The title structure, 3C(2)H(7)N(4)O(+)·HFPO(3) (−)·FPO(3) (2−)·H(2)O, contains three independent 2-carbamoylguanidinium cations, one fluorophosphonate, one hydrogen fluorophosphonate and one water molecule. There are three different layers in the structure that are nearly perpendicular to the c axis. Each layer contains a cation and the layers differ by the respective presence of the water molecule, the hydrogen fluorophosphonate and fluorophosphonate anions. N—H⋯O hydrogen bonds between the guanylurea molecules that interconnect the molecules within each layer are strong. The layers are interconnected by strong and weak O—H⋯O hydrogen bonds between the anions and water molecules, respectively. Interestingly, the configuration of the layers is quite similar to that observed in 2-carbamoylguanidinium hydrogen fluorophosphonate [Fábry et al. (2012). Acta Cryst. C68, o76–o83]. There is also present a N—H⋯F hydrogen bond in the structure which occurs quite rarely. |
format | Online Article Text |
id | pubmed-3254407 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2011 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-32544072012-01-18 Tris(2-carbamoylguanidinium) hydrogen fluorophosphonate fluorophosphonate monohydrate Fábry, Jan Fridrichová, Michaela Dušek, Michal Fejfarová, Karla Krupková, Radmila Acta Crystallogr Sect E Struct Rep Online Organic Papers The title structure, 3C(2)H(7)N(4)O(+)·HFPO(3) (−)·FPO(3) (2−)·H(2)O, contains three independent 2-carbamoylguanidinium cations, one fluorophosphonate, one hydrogen fluorophosphonate and one water molecule. There are three different layers in the structure that are nearly perpendicular to the c axis. Each layer contains a cation and the layers differ by the respective presence of the water molecule, the hydrogen fluorophosphonate and fluorophosphonate anions. N—H⋯O hydrogen bonds between the guanylurea molecules that interconnect the molecules within each layer are strong. The layers are interconnected by strong and weak O—H⋯O hydrogen bonds between the anions and water molecules, respectively. Interestingly, the configuration of the layers is quite similar to that observed in 2-carbamoylguanidinium hydrogen fluorophosphonate [Fábry et al. (2012). Acta Cryst. C68, o76–o83]. There is also present a N—H⋯F hydrogen bond in the structure which occurs quite rarely. International Union of Crystallography 2011-12-07 /pmc/articles/PMC3254407/ /pubmed/22259550 http://dx.doi.org/10.1107/S1600536811051683 Text en © Fábry et al. 2012 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 Fábry, Jan Fridrichová, Michaela Dušek, Michal Fejfarová, Karla Krupková, Radmila Tris(2-carbamoylguanidinium) hydrogen fluorophosphonate fluorophosphonate monohydrate |
title | Tris(2-carbamoylguanidinium) hydrogen fluorophosphonate fluorophosphonate monohydrate |
title_full | Tris(2-carbamoylguanidinium) hydrogen fluorophosphonate fluorophosphonate monohydrate |
title_fullStr | Tris(2-carbamoylguanidinium) hydrogen fluorophosphonate fluorophosphonate monohydrate |
title_full_unstemmed | Tris(2-carbamoylguanidinium) hydrogen fluorophosphonate fluorophosphonate monohydrate |
title_short | Tris(2-carbamoylguanidinium) hydrogen fluorophosphonate fluorophosphonate monohydrate |
title_sort | tris(2-carbamoylguanidinium) hydrogen fluorophosphonate fluorophosphonate monohydrate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3254407/ https://www.ncbi.nlm.nih.gov/pubmed/22259550 http://dx.doi.org/10.1107/S1600536811051683 |
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