Information card for entry 4322249

Structure parameters

• Formula: La16 Mo21 O56
• Calculated formula: La16 Mo21 O56
• Title of publication: Synthesis, Physical Properties, and Theoretical Study of R~16~Mo~21~O~56~ Compounds (R = La, Ce, Pr, and Nd) Containing Bioctahedral Mo~10~ Clusters and Single Mo Atoms
• Authors of publication: Philippe Gall; Régis Gautier; Jean-François Halet; Patrick Gougeon
• Journal of publication: Inorganic Chemistry
• Year of publication: 1999
• Journal volume: 38
• Pages of publication: 4455 - 4461
• a: 13.532 ± 0.002 Å
• b: 13.4642 ± 0.0013 Å
• c: 13.447 ± 0.002 Å
• α: 90°
• β: 99.681 ± 0.007°
• γ: 90°
• Cell volume: 2415.1 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0375
• Residual factor for significantly intense reflections: 0.0264
• Weighted residual factors for all reflections: 0.0584
• Weighted residual factors for significantly intense reflections: 0.0565
• Goodness-of-fit parameter for all reflections: 1.248
• Goodness-of-fit parameter for significantly intense reflections: 1.302
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No