Information card for entry 4114760

Structure parameters

• Formula: Ba O7 Te3
• Calculated formula: Ba O7 Te3
• Title of publication: Lone-Pair Self-Containment in Tellurite Tubes: Hydrothermal Syntheses and Structures of BaTe3O7 and BaTe4O9
• Authors of publication: Magnus G. Johnston; William T. A. Harrison
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2002
• Journal volume: 124
• Pages of publication: 4576 - 4577
• a: 10.2765 ± 0.0006 Å
• b: 5.251 ± 0.0003 Å
• c: 13.5499 ± 0.0008 Å
• α: 90°
• β: 98.98 ± 0.001°
• γ: 90°
• Cell volume: 722.22 ± 0.07 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0371
• Residual factor for significantly intense reflections: 0.0299
• Weighted residual factors for significantly intense reflections: 0.0687
• Weighted residual factors for all reflections included in the refinement: 0.0709
• Goodness-of-fit parameter for all reflections included in the refinement: 0.982
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No