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Crystal structure and Hirshfeld surface analysis of bis(μ-4-tert-butoxy-4-oxobut-2-en-2-olato)bis[(4-tert-butoxy-4-oxobut-2-en-2-olato)ethanolzinc(II)]
The molecular and crystal structure of the title binuclear Zn(2+) complex, [Zn(2)(C(8)H(13)O(3))(4)(C(2)H(5)OH)(2)], with enolated anionic tert-butylacetoacetate and ethanol was analysed. The coordination polyhedra of the Zn atoms are distorted octahedra formed by six oxygen atoms that belong to...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2023
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10162079/ https://www.ncbi.nlm.nih.gov/pubmed/37151829 http://dx.doi.org/10.1107/S2056989023003377 |
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author | Shtokvysh, Olherd O. Dyakonenko, Viktoriya V. Koval, Lyudmila I. Pekhnyo, Vasyl I. |
author_facet | Shtokvysh, Olherd O. Dyakonenko, Viktoriya V. Koval, Lyudmila I. Pekhnyo, Vasyl I. |
author_sort | Shtokvysh, Olherd O. |
collection | PubMed |
description | The molecular and crystal structure of the title binuclear Zn(2+) complex, [Zn(2)(C(8)H(13)O(3))(4)(C(2)H(5)OH)(2)], with enolated anionic tert-butylacetoacetate and ethanol was analysed. The coordination polyhedra of the Zn atoms are distorted octahedra formed by six oxygen atoms that belong to three ligand molecules and a coordinated ethanol molecule. In the crystal phase, alternating layers can be distinguished parallel to the ac plane. A Hirshfeld surface analysis showed that there are no strong intermolecular interactions in the structure. The most significant contributions to the overall crystal packing are from H⋯H intermolecular contacts. |
format | Online Article Text |
id | pubmed-10162079 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2023 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-101620792023-05-06 Crystal structure and Hirshfeld surface analysis of bis(μ-4-tert-butoxy-4-oxobut-2-en-2-olato)bis[(4-tert-butoxy-4-oxobut-2-en-2-olato)ethanolzinc(II)] Shtokvysh, Olherd O. Dyakonenko, Viktoriya V. Koval, Lyudmila I. Pekhnyo, Vasyl I. Acta Crystallogr E Crystallogr Commun Research Communications The molecular and crystal structure of the title binuclear Zn(2+) complex, [Zn(2)(C(8)H(13)O(3))(4)(C(2)H(5)OH)(2)], with enolated anionic tert-butylacetoacetate and ethanol was analysed. The coordination polyhedra of the Zn atoms are distorted octahedra formed by six oxygen atoms that belong to three ligand molecules and a coordinated ethanol molecule. In the crystal phase, alternating layers can be distinguished parallel to the ac plane. A Hirshfeld surface analysis showed that there are no strong intermolecular interactions in the structure. The most significant contributions to the overall crystal packing are from H⋯H intermolecular contacts. International Union of Crystallography 2023-04-21 /pmc/articles/PMC10162079/ /pubmed/37151829 http://dx.doi.org/10.1107/S2056989023003377 Text en © Shtokvysh et al. 2023 https://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. |
spellingShingle | Research Communications Shtokvysh, Olherd O. Dyakonenko, Viktoriya V. Koval, Lyudmila I. Pekhnyo, Vasyl I. Crystal structure and Hirshfeld surface analysis of bis(μ-4-tert-butoxy-4-oxobut-2-en-2-olato)bis[(4-tert-butoxy-4-oxobut-2-en-2-olato)ethanolzinc(II)] |
title | Crystal structure and Hirshfeld surface analysis of bis(μ-4-tert-butoxy-4-oxobut-2-en-2-olato)bis[(4-tert-butoxy-4-oxobut-2-en-2-olato)ethanolzinc(II)] |
title_full | Crystal structure and Hirshfeld surface analysis of bis(μ-4-tert-butoxy-4-oxobut-2-en-2-olato)bis[(4-tert-butoxy-4-oxobut-2-en-2-olato)ethanolzinc(II)] |
title_fullStr | Crystal structure and Hirshfeld surface analysis of bis(μ-4-tert-butoxy-4-oxobut-2-en-2-olato)bis[(4-tert-butoxy-4-oxobut-2-en-2-olato)ethanolzinc(II)] |
title_full_unstemmed | Crystal structure and Hirshfeld surface analysis of bis(μ-4-tert-butoxy-4-oxobut-2-en-2-olato)bis[(4-tert-butoxy-4-oxobut-2-en-2-olato)ethanolzinc(II)] |
title_short | Crystal structure and Hirshfeld surface analysis of bis(μ-4-tert-butoxy-4-oxobut-2-en-2-olato)bis[(4-tert-butoxy-4-oxobut-2-en-2-olato)ethanolzinc(II)] |
title_sort | crystal structure and hirshfeld surface analysis of bis(μ-4-tert-butoxy-4-oxobut-2-en-2-olato)bis[(4-tert-butoxy-4-oxobut-2-en-2-olato)ethanolzinc(ii)] |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10162079/ https://www.ncbi.nlm.nih.gov/pubmed/37151829 http://dx.doi.org/10.1107/S2056989023003377 |
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