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Crystal structure of the one-dimensional coordination polymer formed by the macrocyclic [Ni(cyclam)](2+) cation and the dianion of diphenylsilanediylbis(4-benzoic acid)
The asymmetric unit of the title compound, catena-poly[[[(1,4,8,11-tetraazacyclotetradecane-κ(4) N (1),N (4),N (8),N (11))nickel(II)]-μ-4,4′-(diphenylsilanediyl)dibenzoato-κ(2) O:O′] sesquihydrate], {[Ni(C(26)H(18)O(4)Si)(C(10)H(24)N(4))]·1.5H(2)O}(n), consists of the halves of the centrosy...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2020
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7274011/ https://www.ncbi.nlm.nih.gov/pubmed/32523766 http://dx.doi.org/10.1107/S2056989020006544 |
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author | Gavrish, Sergey P. Shova, Sergiu Cazacu, Maria Lampeka, Yaroslaw D. |
author_facet | Gavrish, Sergey P. Shova, Sergiu Cazacu, Maria Lampeka, Yaroslaw D. |
author_sort | Gavrish, Sergey P. |
collection | PubMed |
description | The asymmetric unit of the title compound, catena-poly[[[(1,4,8,11-tetraazacyclotetradecane-κ(4) N (1),N (4),N (8),N (11))nickel(II)]-μ-4,4′-(diphenylsilanediyl)dibenzoato-κ(2) O:O′] sesquihydrate], {[Ni(C(26)H(18)O(4)Si)(C(10)H(24)N(4))]·1.5H(2)O}(n), consists of the halves of the centrosymmetric macrocyclic cation and the C (2)-symmetric dicarboxylate dianion and of the water molecule of crystallization. The Ni(2+) ion is coordinated by the four secondary N atoms of the macrocyclic ligand characterized by the most energetically favourable trans-III conformation and two mutually trans O atoms of the carboxylate, forming a slightly tetragonally elongated trans-N(4)O(2) octahedron. The crystals are composed of parallel polymeric chains of the macrocyclic cations linked by the anions of the acid running along the [101] direction. Each polymeric chain is bonded to four neighbouring ones via water molecules providing O—H⋯O hydrogen bonds to the non-coordinated carboxyl O atoms to form a three-dimensional supramolecular network. |
format | Online Article Text |
id | pubmed-7274011 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2020 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-72740112020-06-09 Crystal structure of the one-dimensional coordination polymer formed by the macrocyclic [Ni(cyclam)](2+) cation and the dianion of diphenylsilanediylbis(4-benzoic acid) Gavrish, Sergey P. Shova, Sergiu Cazacu, Maria Lampeka, Yaroslaw D. Acta Crystallogr E Crystallogr Commun Research Communications The asymmetric unit of the title compound, catena-poly[[[(1,4,8,11-tetraazacyclotetradecane-κ(4) N (1),N (4),N (8),N (11))nickel(II)]-μ-4,4′-(diphenylsilanediyl)dibenzoato-κ(2) O:O′] sesquihydrate], {[Ni(C(26)H(18)O(4)Si)(C(10)H(24)N(4))]·1.5H(2)O}(n), consists of the halves of the centrosymmetric macrocyclic cation and the C (2)-symmetric dicarboxylate dianion and of the water molecule of crystallization. The Ni(2+) ion is coordinated by the four secondary N atoms of the macrocyclic ligand characterized by the most energetically favourable trans-III conformation and two mutually trans O atoms of the carboxylate, forming a slightly tetragonally elongated trans-N(4)O(2) octahedron. The crystals are composed of parallel polymeric chains of the macrocyclic cations linked by the anions of the acid running along the [101] direction. Each polymeric chain is bonded to four neighbouring ones via water molecules providing O—H⋯O hydrogen bonds to the non-coordinated carboxyl O atoms to form a three-dimensional supramolecular network. International Union of Crystallography 2020-05-29 /pmc/articles/PMC7274011/ /pubmed/32523766 http://dx.doi.org/10.1107/S2056989020006544 Text en © Gavrish et al. 2020 http://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.http://creativecommons.org/licenses/by/4.0/ |
spellingShingle | Research Communications Gavrish, Sergey P. Shova, Sergiu Cazacu, Maria Lampeka, Yaroslaw D. Crystal structure of the one-dimensional coordination polymer formed by the macrocyclic [Ni(cyclam)](2+) cation and the dianion of diphenylsilanediylbis(4-benzoic acid) |
title | Crystal structure of the one-dimensional coordination polymer formed by the macrocyclic [Ni(cyclam)](2+) cation and the dianion of diphenylsilanediylbis(4-benzoic acid) |
title_full | Crystal structure of the one-dimensional coordination polymer formed by the macrocyclic [Ni(cyclam)](2+) cation and the dianion of diphenylsilanediylbis(4-benzoic acid) |
title_fullStr | Crystal structure of the one-dimensional coordination polymer formed by the macrocyclic [Ni(cyclam)](2+) cation and the dianion of diphenylsilanediylbis(4-benzoic acid) |
title_full_unstemmed | Crystal structure of the one-dimensional coordination polymer formed by the macrocyclic [Ni(cyclam)](2+) cation and the dianion of diphenylsilanediylbis(4-benzoic acid) |
title_short | Crystal structure of the one-dimensional coordination polymer formed by the macrocyclic [Ni(cyclam)](2+) cation and the dianion of diphenylsilanediylbis(4-benzoic acid) |
title_sort | crystal structure of the one-dimensional coordination polymer formed by the macrocyclic [ni(cyclam)](2+) cation and the dianion of diphenylsilanediylbis(4-benzoic acid) |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7274011/ https://www.ncbi.nlm.nih.gov/pubmed/32523766 http://dx.doi.org/10.1107/S2056989020006544 |
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