Information card for entry 2219060

Structure parameters

• Chemical name: hexakis(μ-chloroacetato-κ^2^<i>O</i>:<i>O</i>')-μ~3~-oxido- tris[aquachromium(III)] nitrate 3.5-hydrate
• Formula: C12 H25 Cl6 Cr3 N O22.5
• Calculated formula: C12 H25 Cl6 Cr3 N O22.5
• Title of publication: Low-temperature redetermination of hexakis(μ-chloroacetato-κ^2^<i>O</i>:<i>O</i>')-μ~3~-oxido-tris[aquachromium(III)] nitrate 3.5-hydrate
• Authors of publication: Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 8
• Pages of publication: m1102
• a: 12.4938 ± 0.0002 Å
• b: 14.7622 ± 0.0002 Å
• c: 17.2687 ± 0.0003 Å
• α: 90°
• β: 96.293 ± 0.001°
• γ: 90°
• Cell volume: 3165.78 ± 0.09 ų
• Cell temperature: 100 ± 2 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: 0.0641
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for significantly intense reflections: 0.0999
• Weighted residual factors for all reflections included in the refinement: 0.1124
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes