Information card for entry 7249890

Structure parameters

• Formula: Cl0 La4.218 Mo3 Na0.782 O15.36
• Calculated formula: Cl0.1152 La4.1922 Mo3 Na0.8078 O15.8848
• Title of publication: Structural features of sodium- and halogen-containing fluorite-like rare-earth molybdates.
• Authors of publication: Antipin, Alexander M.; Orlova, Ekaterina I.; Smirnova, Ekaterina S.; Trukhacheva, Maria P.; Sorokin, Timofei A.; Sidorova, Ekaterina V.; Kharitonova, Elena P.; Lyskov, Nikolay V.; Novikova, Natalia E.; Yapaskurt, Vasiliy O.; Sorokina, Natalia I.; Alekseeva, Olga A.; Voronkova, Valentina I.
• Journal of publication: Physical chemistry chemical physics : PCCP
• Year of publication: 2025
• a: 11.349 ± 0.0011 Å
• b: 11.349 ± 0.0011 Å
• c: 11.349 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1461.7 ± 0.2 ų
• Cell temperature: 1050 ± 0.14 K
• Ambient diffraction temperature: 1050 K
• Number of distinct elements: 5
• Space group number: 222
• Hermann-Mauguin space group symbol: P n -3 n :1
• Hall space group symbol: P 4 2 3 -1n
• Residual factor for all reflections: 0.0348
• Residual factor for significantly intense reflections: 0.0285
• Weighted residual factors for significantly intense reflections: 0.1251
• Weighted residual factors for all reflections included in the refinement: 0.1566
• Goodness-of-fit parameter for significantly intense reflections: 1.2148
• Goodness-of-fit parameter for all reflections included in the refinement: 1.2813
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No