Information card for entry 7036760

Structure parameters

• Formula: Br O2 Sb Zn0.902
• Calculated formula: Br O1.9225 Sb Zn0.75
• Title of publication: Synthesis and crystal structure of a series of incommensurately modulated composite oxohalide compounds.
• Authors of publication: Zimmermann, Iwan; Corgnet, Alexis; Johnsson, Mats; Lidin, Sven
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• a: 4.1307 ± 0.0013 Å
• b: 17.9042 ± 0.0002 Å
• c: 10.3021 ± 0.001 Å
• α: 90°
• β: 90.331 ± 0.006°
• γ: 90°
• Cell volume: 761.9 ± 0.3 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.2549
• Residual factor for significantly intense reflections: 0.0982
• Weighted residual factors for significantly intense reflections: 0.1017
• Weighted residual factors for all reflections included in the refinement: 0.1444
• Goodness-of-fit parameter for significantly intense reflections: 2.02
• Goodness-of-fit parameter for all reflections included in the refinement: 1.4
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No