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Tetra­aqua­[3-oxo-1,3-bis­(pyridinium-2-yl)propan-1-olato]nickel(II) tribromide dihydrate

The crystal structure of the title compound, [Ni(C(13)H(11)N(2)O(2))(H(2)O)(4)]Br(3)·2H(2)O, contains an octa­hedral Ni(II) atom coordinated to the enol form of 1,3-di­pyridyl­propane-1,3-dione (dppo) and four water mol­ecules. Both pyridyl rings on the ligand are protonated, forming pyridinium ring...

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Autores principales: Westcott, Barry L., Crundwell, Guy, Alicea-Velázquez, Nilda L.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7001841/
https://www.ncbi.nlm.nih.gov/pubmed/32071760
http://dx.doi.org/10.1107/S205698902000081X
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author Westcott, Barry L.
Crundwell, Guy
Alicea-Velázquez, Nilda L.
author_facet Westcott, Barry L.
Crundwell, Guy
Alicea-Velázquez, Nilda L.
author_sort Westcott, Barry L.
collection PubMed
description The crystal structure of the title compound, [Ni(C(13)H(11)N(2)O(2))(H(2)O)(4)]Br(3)·2H(2)O, contains an octa­hedral Ni(II) atom coordinated to the enol form of 1,3-di­pyridyl­propane-1,3-dione (dppo) and four water mol­ecules. Both pyridyl rings on the ligand are protonated, forming pyridinium rings and creating an overall ligand charge of +1. The protonated nitro­gen-containing rings are involved in hydrogen-bonding inter­actions with neighoring bromide anions. There are many additional hydrogen-bonding inter­actions involving coordinated water mol­ecules on the Ni(II) atom, bromide anions and hydration water mol­ecules.
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spelling pubmed-70018412020-02-18 Tetra­aqua­[3-oxo-1,3-bis­(pyridinium-2-yl)propan-1-olato]nickel(II) tribromide dihydrate Westcott, Barry L. Crundwell, Guy Alicea-Velázquez, Nilda L. Acta Crystallogr E Crystallogr Commun Research Communications The crystal structure of the title compound, [Ni(C(13)H(11)N(2)O(2))(H(2)O)(4)]Br(3)·2H(2)O, contains an octa­hedral Ni(II) atom coordinated to the enol form of 1,3-di­pyridyl­propane-1,3-dione (dppo) and four water mol­ecules. Both pyridyl rings on the ligand are protonated, forming pyridinium rings and creating an overall ligand charge of +1. The protonated nitro­gen-containing rings are involved in hydrogen-bonding inter­actions with neighoring bromide anions. There are many additional hydrogen-bonding inter­actions involving coordinated water mol­ecules on the Ni(II) atom, bromide anions and hydration water mol­ecules. International Union of Crystallography 2020-01-31 /pmc/articles/PMC7001841/ /pubmed/32071760 http://dx.doi.org/10.1107/S205698902000081X Text en © Westcott 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
Westcott, Barry L.
Crundwell, Guy
Alicea-Velázquez, Nilda L.
Tetra­aqua­[3-oxo-1,3-bis­(pyridinium-2-yl)propan-1-olato]nickel(II) tribromide dihydrate
title Tetra­aqua­[3-oxo-1,3-bis­(pyridinium-2-yl)propan-1-olato]nickel(II) tribromide dihydrate
title_full Tetra­aqua­[3-oxo-1,3-bis­(pyridinium-2-yl)propan-1-olato]nickel(II) tribromide dihydrate
title_fullStr Tetra­aqua­[3-oxo-1,3-bis­(pyridinium-2-yl)propan-1-olato]nickel(II) tribromide dihydrate
title_full_unstemmed Tetra­aqua­[3-oxo-1,3-bis­(pyridinium-2-yl)propan-1-olato]nickel(II) tribromide dihydrate
title_short Tetra­aqua­[3-oxo-1,3-bis­(pyridinium-2-yl)propan-1-olato]nickel(II) tribromide dihydrate
title_sort tetra­aqua­[3-oxo-1,3-bis­(pyridinium-2-yl)propan-1-olato]nickel(ii) tribromide dihydrate
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7001841/
https://www.ncbi.nlm.nih.gov/pubmed/32071760
http://dx.doi.org/10.1107/S205698902000081X
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