Information card for entry 8102167

Structure parameters

• Chemical name: dimethyl-μ-oxosilane-dibromo-zirconium(IV) di(nonabromozirconate(IV)),
• Formula: C12 H36 Br20 O6 Si6 Zr5
• Calculated formula: C12 H36 Br20 O6 Si6 Zr5
• Title of publication: Crystal structure of hexakis(dimethyl-μ-oxosilane)dibromozirconium (IV) bis(nonabromodizirconate(IV)), [Zr{(CH~3~)~2~SiO}~6~Br~2~][Zr~2~Br~9~] ~2~
• Authors of publication: Ernst, Richard D.; Glöckner, Andreas; Arif, Atta M.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2007
• Journal volume: 222
• Journal issue: 3
• Pages of publication: 333 - 334
• a: 9.8087 ± 0.0002 Å
• b: 22.7606 ± 0.0004 Å
• c: 13.6501 ± 0.0002 Å
• α: 90°
• β: 97.6453 ± 0.0011°
• γ: 90°
• Cell volume: 3020.32 ± 0.09 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 6
• 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: 0.0711
• Residual factor for significantly intense reflections: 0.0423
• Weighted residual factors for significantly intense reflections: 0.0807
• Weighted residual factors for all reflections included in the refinement: 0.088
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No