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Crystal structures of two solvates of (18-crown-6)potassium acetate
The crystal and molecular strutures of two solvated forms of [K(18c6)]OAc (18c6 = 18-crown-6 = 1,4,7,10,13,16-hexaoxacyclooctadecane and OAc = acetate) were determined by single-crystal X-ray diffraction, namely (acetato-κ(2) O,O′)(1,4,7,10,13,16-hexaoxacyclooctadecane-κ(6) O)potassium dihy...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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International Union of Crystallography
2016
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5137602/ https://www.ncbi.nlm.nih.gov/pubmed/27980824 http://dx.doi.org/10.1107/S2056989016017436 |
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author | Liebing, Phil Zaeni, Ahmad Olbrich, Falk Edelmann, Frank T. |
author_facet | Liebing, Phil Zaeni, Ahmad Olbrich, Falk Edelmann, Frank T. |
author_sort | Liebing, Phil |
collection | PubMed |
description | The crystal and molecular strutures of two solvated forms of [K(18c6)]OAc (18c6 = 18-crown-6 = 1,4,7,10,13,16-hexaoxacyclooctadecane and OAc = acetate) were determined by single-crystal X-ray diffraction, namely (acetato-κ(2) O,O′)(1,4,7,10,13,16-hexaoxacyclooctadecane-κ(6) O)potassium dihydrate, [K(CH(3)COO)(C(12)H(24)O(6))]·2H(2)O (1) and (acetato-κ(2) O,O′)aqua(1,4,7,10,13,16-hexaoxacyclooctadecane-κ(6) O)potassium acetic acid monosolvate [K(CH(3)COO)(C(12)H(24)O(6))(H(2)O)]·CH(3)COOH (2). In both compounds, the acetate anion is bonded to the potassium ion in a chelating fashion and the metal atom is consequently slightly displaced from the O(6) plane of the crown ether. In the crystals, O—H⋯O hydrogen bonds lead to a polymeric ladder structure in the dihydrate 1, while the acetic acid hydrate 2 features inversion dimers. |
format | Online Article Text |
id | pubmed-5137602 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2016 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-51376022016-12-15 Crystal structures of two solvates of (18-crown-6)potassium acetate Liebing, Phil Zaeni, Ahmad Olbrich, Falk Edelmann, Frank T. Acta Crystallogr E Crystallogr Commun Research Communications The crystal and molecular strutures of two solvated forms of [K(18c6)]OAc (18c6 = 18-crown-6 = 1,4,7,10,13,16-hexaoxacyclooctadecane and OAc = acetate) were determined by single-crystal X-ray diffraction, namely (acetato-κ(2) O,O′)(1,4,7,10,13,16-hexaoxacyclooctadecane-κ(6) O)potassium dihydrate, [K(CH(3)COO)(C(12)H(24)O(6))]·2H(2)O (1) and (acetato-κ(2) O,O′)aqua(1,4,7,10,13,16-hexaoxacyclooctadecane-κ(6) O)potassium acetic acid monosolvate [K(CH(3)COO)(C(12)H(24)O(6))(H(2)O)]·CH(3)COOH (2). In both compounds, the acetate anion is bonded to the potassium ion in a chelating fashion and the metal atom is consequently slightly displaced from the O(6) plane of the crown ether. In the crystals, O—H⋯O hydrogen bonds lead to a polymeric ladder structure in the dihydrate 1, while the acetic acid hydrate 2 features inversion dimers. International Union of Crystallography 2016-11-08 /pmc/articles/PMC5137602/ /pubmed/27980824 http://dx.doi.org/10.1107/S2056989016017436 Text en © Liebing et al. 2016 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 Liebing, Phil Zaeni, Ahmad Olbrich, Falk Edelmann, Frank T. Crystal structures of two solvates of (18-crown-6)potassium acetate |
title | Crystal structures of two solvates of (18-crown-6)potassium acetate |
title_full | Crystal structures of two solvates of (18-crown-6)potassium acetate |
title_fullStr | Crystal structures of two solvates of (18-crown-6)potassium acetate |
title_full_unstemmed | Crystal structures of two solvates of (18-crown-6)potassium acetate |
title_short | Crystal structures of two solvates of (18-crown-6)potassium acetate |
title_sort | crystal structures of two solvates of (18-crown-6)potassium acetate |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5137602/ https://www.ncbi.nlm.nih.gov/pubmed/27980824 http://dx.doi.org/10.1107/S2056989016017436 |
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