Information card for entry 4133774

Structure parameters

• Formula: K1.42 Li0.6 Na1.28 Ni3.01 O133.68 P5 W30
• Calculated formula: K1.422 Li0.6 Na1.28 Ni3.004 O133.675 P5 W30
• Title of publication: Tunable Metal Oxide Frameworks via Coordination Assembly of Preyssler-Type Molecular Clusters.
• Authors of publication: Chen, Linfeng; San, Khin A.; Turo, Michael J.; Gembicky, Milan; Fereidouni, Shelir; Kalaj, Mark; Schimpf, Alina M.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• a: 52.101 ± 0.009 Å
• b: 21.545 ± 0.004 Å
• c: 26.104 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 29302 ± 9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• Space group number: 74
• Hermann-Mauguin space group symbol: I m m a
• Hall space group symbol: -I 2b 2
• Residual factor for all reflections: 0.1215
• Residual factor for significantly intense reflections: 0.0864
• Weighted residual factors for significantly intense reflections: 0.1811
• Weighted residual factors for all reflections included in the refinement: 0.2118
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No