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Diaquabis(2-hydroxybenzoato-κO (1))bis(nicotinamide-κN (1))cadmium–diaquabis(2-hydroxybenzoato-κ(2) O (1),O (1′))(nicotinamide-κN)cadmium–water (1/2/4)
The crystal structure of the title compound, [Cd(C(7)H(5)O(3))(2)(C(6)H(6)NO)(2)(H(2)O)(2)]·2[Cd(C(7)H(5)O(3))(2)(C(6)H(6)NO)(H(2)O)(2)]·4H(2)O, consists of two kinds of Cd(II) complexes (A and B) and lattice water molecules. In complex A, [Cd(C(7)H(5)O(3))(2)(C(6)H(6)NO)(2)(H(2)O)(2)], the Cd(II)...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2013
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3629475/ https://www.ncbi.nlm.nih.gov/pubmed/23633993 http://dx.doi.org/10.1107/S1600536813006168 |
Sumario: | The crystal structure of the title compound, [Cd(C(7)H(5)O(3))(2)(C(6)H(6)NO)(2)(H(2)O)(2)]·2[Cd(C(7)H(5)O(3))(2)(C(6)H(6)NO)(H(2)O)(2)]·4H(2)O, consists of two kinds of Cd(II) complexes (A and B) and lattice water molecules. In complex A, [Cd(C(7)H(5)O(3))(2)(C(6)H(6)NO)(2)(H(2)O)(2)], the Cd(II) cation is located on an inversion center and is coordinated by two salicylate anions, two nicotinamide (NA) ligands and two water molecules in a slightly distorted octahedral geometry. In complex B, [Cd(C(7)H(5)O(3))(2)(C(6)H(6)NO)(H(2)O)(2)], the Cd(II) cation is coordinated by two salicylate anions, one nicotinamide (NA) ligand and two water molecules in an irregular seven-coordinate geometry. There are extensive intramolecular O—H⋯O and weak C—H⋯O hydrogen bonds as well as extensive intermolecular O—H⋯O and N—H⋯O hydrogen bonding in the crystal structure. π–π stacking between the pyridine and benzene rings, between the benzene rings, between the benzene and pyridine rings and between the pyridine rings [centroid–centroid distances = 3.5989 (10), 3.6005 (10), 3.5800 (9) and 3.5205 (10) Å, respectively] further stabilize the crystal structure. A weak N—H⋯π interaction also occurs. One of the lattice water molecules is disordered over two positions with an occupancy ratio of 0.70:0.30. |
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