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Crystal structure and Hirshfeld surface analysis of tetraaquabis(isonicotinamide-κN (1))nickel(II) fumarate
The reaction of NiCl(2) with fumaric acid and isonicotinamide in a basic solution produces the title complex, [Ni(C(6)H(6)N(2)O)(2)(H(2)O)(4)](C(4)H(2)O(4)). The nickel(II) ion of the complex cation and the fumarate anion are each located on an inversion centre. The Ni(II) ion is coordinated octahe...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2018
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6218910/ https://www.ncbi.nlm.nih.gov/pubmed/30443375 http://dx.doi.org/10.1107/S2056989018013580 |
Sumario: | The reaction of NiCl(2) with fumaric acid and isonicotinamide in a basic solution produces the title complex, [Ni(C(6)H(6)N(2)O)(2)(H(2)O)(4)](C(4)H(2)O(4)). The nickel(II) ion of the complex cation and the fumarate anion are each located on an inversion centre. The Ni(II) ion is coordinated octahedrally by four water O atoms and two N atoms of isonicotinamide molecules. The fumarate anion is linked to neighbouring complex cations via O(water)—H⋯O(fumarate) hydrogen bonds. In the crystal, the complex cations are further linked by O—H⋯O, N—H⋯O and C—H⋯O hydrogen bonds, forming a three-dimensional supramolecular architecture. Hirshfeld surface analysis and two-dimensional fingerprint plots were used to analyse the intermolecular interactions present in the crystal and indicate that the most important contributions for the crystal packing are from H⋯O/O⋯H (41.8%), H⋯H (35.3%) and H⋯C/C⋯H (10.2%) interactions. |
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