Information card for entry 1562948

Structure parameters

• Formula: H4 Li4 O14 Rb2 Se3
• Calculated formula: H4 Li4 O14 Rb2 Se3
• Title of publication: Local structure of Rb2Li4(SeO4)3·2H2O by the modeling of X-ray diffuse scattering — from average-structure to microdomain model
• Authors of publication: Komornicka, Dorota; Wołcyrz, Marek; Pietraszko, Adam
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2012
• Journal volume: 192
• Pages of publication: 54 - 59
• a: 5.2625 ± 0.0011 Å
• b: 5.182 ± 0.001 Å
• c: 26.762 ± 0.005 Å
• α: 90°
• β: 93.18 ± 0.03°
• γ: 90°
• Cell volume: 728.7 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0696
• Residual factor for significantly intense reflections: 0.0536
• Weighted residual factors for significantly intense reflections: 0.0894
• Weighted residual factors for all reflections included in the refinement: 0.0934
• Goodness-of-fit parameter for all reflections included in the refinement: 1.108
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No