Information card for entry 4030904

Structure parameters

• Formula: H36 Mo6 Ni3 O42 Te
• Calculated formula: Mo6 Ni3 O42 Te
• SMILES: [Ni]([OH2])([OH2])([OH2])([OH2])([OH2])[OH2].[O]12[Te]3456[O]7[Mo]81(=O)(O[Mo]17(O[Mo]7(O[Mo]9(O[Mo]%10(O[Mo]2([O]3%10)(O8)(=O)=O)([O]49)(=O)=O)([O]57)(=O)=O)([O]61)(=O)=O)(=O)=O)=O.[Ni]([OH2])([OH2])([OH2])([OH2])([OH2])[OH2].[OH2][Ni]([OH2])([OH2])([OH2])([OH2])[OH2]
• Title of publication: Synthesis and characterization of the molybdotellurates : [M(H2O)6]3.[TeMo6O24] : M = Ni(II) and Co(II)
• Authors of publication: Lorenzo-Luis, P. A.; Martin-Zarza, P.; Gili, P.; Saez Puche, R.; Jimenez-Jimenez, J.; Rodriguez-Castellon, E.; Ruiz-Perez, C.; Gonzalez-Platas, J.; Solans, X.
• Journal of publication: European Journal of Solid State and Inorganic Chemistry
• Year of publication: 1997
• Journal volume: 34
• Pages of publication: 1259 - 1271
• a: 17.906 ± 0.005 Å
• b: 17.906 ± 0.005 Å
• c: 19.458 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 5403 ± 3 ų
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for significantly intense reflections: 0.0547
• Weighted residual factors for significantly intense reflections: 0.1417
• Goodness-of-fit parameter for all reflections included in the refinement: 1.394
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No