Cargando…
Crystal structure and Hirshfeld surface analysis of poly[[bis[μ(4)-N,N′-(1,3,5-oxadiazinane-3,5-diyl)bis(carbamoylmethanoato)]nickel(II)tetrapotassium] 4.8-hydrate]
The title compound, {[K(4)Ni(2)(C(7)H(6)N(4)O(7))(2)]·4.8H(2)O}(n), was obtained as a result of a template reaction between oxalohydrazidehydroxamic acid, formaldehyde and nickel(II) nitrate followed by partial hydrolysis of the formed intermediate. The two independent [Ni(C(7)H(6)N(4)O(7))](2–) c...
Autores principales: | , , , , |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2021
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8061116/ https://www.ncbi.nlm.nih.gov/pubmed/33953955 http://dx.doi.org/10.1107/S205698902100205X |
_version_ | 1783681501373661184 |
---|---|
author | Plutenko, Maksym O. Haukka, Matti Husak, Alina O. Iskenderov, Turganbay S. Mulloev, Nurullo U. |
author_facet | Plutenko, Maksym O. Haukka, Matti Husak, Alina O. Iskenderov, Turganbay S. Mulloev, Nurullo U. |
author_sort | Plutenko, Maksym O. |
collection | PubMed |
description | The title compound, {[K(4)Ni(2)(C(7)H(6)N(4)O(7))(2)]·4.8H(2)O}(n), was obtained as a result of a template reaction between oxalohydrazidehydroxamic acid, formaldehyde and nickel(II) nitrate followed by partial hydrolysis of the formed intermediate. The two independent [Ni(C(7)H(6)N(4)O(7))](2–) complex anions exhibit pseudo-C (S) symmetry and consist of an almost planar metal-containing fragment and a 1,3,5-oxadiazinane ring with a chair conformation disposed nearly perpendicularly with respect to the former. The central Ni(II) atom has a square-planar N(2)O(2) coordination arrangement formed by two amide N and two carboxylate O atoms. In the crystal, the nickel(II) complex anions form layers parallel to the ab plane. Neighboring complex anion layers are connected by layers of potassium cations for which two of the four independent cations are disordered over two sites [ratios of 0.54 (3):0.46 (3) and 0.9643 (15):0.0357 (15)]. The framework is stabilized by an extensive system of hydrogen bonds where the water molecules act as donors and the carboxylic O atoms, the amide O atoms and the oxadiazinane N atoms act as acceptors. |
format | Online Article Text |
id | pubmed-8061116 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2021 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-80611162021-05-04 Crystal structure and Hirshfeld surface analysis of poly[[bis[μ(4)-N,N′-(1,3,5-oxadiazinane-3,5-diyl)bis(carbamoylmethanoato)]nickel(II)tetrapotassium] 4.8-hydrate] Plutenko, Maksym O. Haukka, Matti Husak, Alina O. Iskenderov, Turganbay S. Mulloev, Nurullo U. Acta Crystallogr E Crystallogr Commun Research Communications The title compound, {[K(4)Ni(2)(C(7)H(6)N(4)O(7))(2)]·4.8H(2)O}(n), was obtained as a result of a template reaction between oxalohydrazidehydroxamic acid, formaldehyde and nickel(II) nitrate followed by partial hydrolysis of the formed intermediate. The two independent [Ni(C(7)H(6)N(4)O(7))](2–) complex anions exhibit pseudo-C (S) symmetry and consist of an almost planar metal-containing fragment and a 1,3,5-oxadiazinane ring with a chair conformation disposed nearly perpendicularly with respect to the former. The central Ni(II) atom has a square-planar N(2)O(2) coordination arrangement formed by two amide N and two carboxylate O atoms. In the crystal, the nickel(II) complex anions form layers parallel to the ab plane. Neighboring complex anion layers are connected by layers of potassium cations for which two of the four independent cations are disordered over two sites [ratios of 0.54 (3):0.46 (3) and 0.9643 (15):0.0357 (15)]. The framework is stabilized by an extensive system of hydrogen bonds where the water molecules act as donors and the carboxylic O atoms, the amide O atoms and the oxadiazinane N atoms act as acceptors. International Union of Crystallography 2021-02-26 /pmc/articles/PMC8061116/ /pubmed/33953955 http://dx.doi.org/10.1107/S205698902100205X Text en © Plutenko et al. 2021 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 Plutenko, Maksym O. Haukka, Matti Husak, Alina O. Iskenderov, Turganbay S. Mulloev, Nurullo U. Crystal structure and Hirshfeld surface analysis of poly[[bis[μ(4)-N,N′-(1,3,5-oxadiazinane-3,5-diyl)bis(carbamoylmethanoato)]nickel(II)tetrapotassium] 4.8-hydrate] |
title | Crystal structure and Hirshfeld surface analysis of poly[[bis[μ(4)-N,N′-(1,3,5-oxadiazinane-3,5-diyl)bis(carbamoylmethanoato)]nickel(II)tetrapotassium] 4.8-hydrate] |
title_full | Crystal structure and Hirshfeld surface analysis of poly[[bis[μ(4)-N,N′-(1,3,5-oxadiazinane-3,5-diyl)bis(carbamoylmethanoato)]nickel(II)tetrapotassium] 4.8-hydrate] |
title_fullStr | Crystal structure and Hirshfeld surface analysis of poly[[bis[μ(4)-N,N′-(1,3,5-oxadiazinane-3,5-diyl)bis(carbamoylmethanoato)]nickel(II)tetrapotassium] 4.8-hydrate] |
title_full_unstemmed | Crystal structure and Hirshfeld surface analysis of poly[[bis[μ(4)-N,N′-(1,3,5-oxadiazinane-3,5-diyl)bis(carbamoylmethanoato)]nickel(II)tetrapotassium] 4.8-hydrate] |
title_short | Crystal structure and Hirshfeld surface analysis of poly[[bis[μ(4)-N,N′-(1,3,5-oxadiazinane-3,5-diyl)bis(carbamoylmethanoato)]nickel(II)tetrapotassium] 4.8-hydrate] |
title_sort | crystal structure and hirshfeld surface analysis of poly[[bis[μ(4)-n,n′-(1,3,5-oxadiazinane-3,5-diyl)bis(carbamoylmethanoato)]nickel(ii)tetrapotassium] 4.8-hydrate] |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8061116/ https://www.ncbi.nlm.nih.gov/pubmed/33953955 http://dx.doi.org/10.1107/S205698902100205X |
work_keys_str_mv | AT plutenkomaksymo crystalstructureandhirshfeldsurfaceanalysisofpolybism4nn135oxadiazinane35diylbiscarbamoylmethanoatonickeliitetrapotassium48hydrate AT haukkamatti crystalstructureandhirshfeldsurfaceanalysisofpolybism4nn135oxadiazinane35diylbiscarbamoylmethanoatonickeliitetrapotassium48hydrate AT husakalinao crystalstructureandhirshfeldsurfaceanalysisofpolybism4nn135oxadiazinane35diylbiscarbamoylmethanoatonickeliitetrapotassium48hydrate AT iskenderovturganbays crystalstructureandhirshfeldsurfaceanalysisofpolybism4nn135oxadiazinane35diylbiscarbamoylmethanoatonickeliitetrapotassium48hydrate AT mulloevnurullou crystalstructureandhirshfeldsurfaceanalysisofpolybism4nn135oxadiazinane35diylbiscarbamoylmethanoatonickeliitetrapotassium48hydrate |