Information card for entry 1570229

Structure parameters

• Formula: Co4 Fe2 Na14 O97 W18
• Calculated formula: Co4 Fe2 Na14 O95 W18
• Title of publication: Accelerating water oxidation - a mixed Co/Fe polyoxometalate with improved turnover characteristics.
• Authors of publication: Soriano-López, Joaquín; Steuber, Friedrich W.; Mulahmetović, Muhamed; Besora, Maria; Clemente-Juan, Juan Modesto; O'Doherty, Mariah; Zhu, Nian-Yong; Hill, Craig L.; Coronado, Eugenio; Poblet, Josep M.; Schmitt, Wolfgang
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 47
• Pages of publication: 13722 - 13733
• a: 26.056 ± 0.003 Å
• b: 20.996 ± 0.003 Å
• c: 17.747 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9709 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.01 K
• Number of distinct elements: 5
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.1452
• Residual factor for significantly intense reflections: 0.0934
• Weighted residual factors for significantly intense reflections: 0.241
• Weighted residual factors for all reflections included in the refinement: 0.2896
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No