Information card for entry 7036770

Structure parameters

• Formula: I4 O8 Sb4 Zn3.682
• Calculated formula: I4 O7.69 Sb4 Zn3
• 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: 4.271 ± 0.0008 Å
• b: 18.508 ± 0.003 Å
• c: 10.6741 ± 0.0014 Å
• α: 90°
• β: 90.054 ± 0.013°
• γ: 90°
• Cell volume: 843.8 ± 0.2 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: 0.2432
• Residual factor for significantly intense reflections: 0.0729
• Weighted residual factors for significantly intense reflections: 0.0711
• Weighted residual factors for all reflections included in the refinement: 0.1082
• Goodness-of-fit parameter for significantly intense reflections: 1.51
• Goodness-of-fit parameter for all reflections included in the refinement: 1.12
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No