Information card for entry 7057443

Structure parameters

• Formula: Cs Li Mo3 O10
• Calculated formula: Cs Li Mo3 O10
• Title of publication: Four alkali metal molybdates with two types of Mo‒O chains, ABMo3O10 (A = Li, B = Rb; A = Li, Na, K, B = Cs): synthesis, structure comparison and optical properties
• Authors of publication: Han, Shujuan; Zhang, Bingbing; Tong, Tinghao; Yang, Zhihua; Pan, Shilie
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 13
• Pages of publication: 10879
• a: 8.652 ± 0.002 Å
• b: 7.5688 ± 0.0018 Å
• c: 13.895 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 909.9 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0264
• Residual factor for significantly intense reflections: 0.0208
• Weighted residual factors for significantly intense reflections: 0.0394
• Weighted residual factors for all reflections included in the refinement: 0.0443
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No