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Crystal structure and Hirshfeld surface analysis of bis(3-aminopyrazole-κN (1))bis(3-aminopyrazole-κN (2))bis(nitrato-κO)copper(II)
In the crystal structure of the title compound, [Cu(NO(3))(2)(C(3)H(5)N(3))(4)], the Cu(II) atom is situated on an inversion center (Wyckoff position 2c of space group P2(1)/n) and shows an octahedral [N(4)O(2)] coordination environment. The axial positions are occupied by O atoms of nitrate anions...
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/PMC10626959/ https://www.ncbi.nlm.nih.gov/pubmed/37936845 http://dx.doi.org/10.1107/S2056989023009295 |
Sumario: | In the crystal structure of the title compound, [Cu(NO(3))(2)(C(3)H(5)N(3))(4)], the Cu(II) atom is situated on an inversion center (Wyckoff position 2c of space group P2(1)/n) and shows an octahedral [N(4)O(2)] coordination environment. The axial positions are occupied by O atoms of nitrate anions, while the equatorial positions are taken up by the N atoms of four 3-aminopyrazole ligands. As a result of the tautomerism of the latter, two coordinate with the N(1)-atom of 3-aminopyrazole while the other two with the N(2)-atom. The presence of pyrrole-like N—H groups and amine substituents as donor groups leads to numerous intra- and intermolecular hydrogen-bonding interactions, which were quantified by Hirshfeld surface analysis. |
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