Information card for entry 7718803

Structure parameters

• Formula: C64 H144 Al N4 O40 P W11
• Calculated formula: Al0.9996 O40 P W11.0004
• Title of publication: Synthesis and characterization of Al and Si substituted polyoxometalates.
• Authors of publication: Raabe, Jan-Christian; Chitnis, Saurabh S.; Poller, Maximilian J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 24
• Pages of publication: 9483 - 9488
• a: 17.4284 ± 0.0002 Å
• b: 17.4284 ± 0.0002 Å
• c: 17.4284 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5293.86 ± 0.11 ų
• Cell temperature: 99.95 ± 0.13 K
• Ambient diffraction temperature: 99.95 ± 0.13 K
• Number of distinct elements: 7
• Space group number: 229
• Hermann-Mauguin space group symbol: I m -3 m
• Hall space group symbol: -I 4 2 3
• Residual factor for all reflections: 0.0784
• Residual factor for significantly intense reflections: 0.0571
• Weighted residual factors for significantly intense reflections: 0.0929
• Weighted residual factors for all reflections included in the refinement: 0.1046
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No