Information card for entry 2013915

Structure parameters

• Chemical name: Cesium aquapentachlorochromate(III)
• Formula: Cl5 Cr Cs2 H2 O
• Calculated formula: Cl5 Cr Cs2 O
• SMILES: [OH2][Cr](Cl)(Cl)(Cl)(Cl)Cl.[Cs+].[Cs+]
• Title of publication: Dirubidium aquapentachlorochromate(III) and dicaesium aquapentachlorochromate(III)
• Authors of publication: Annika K. Eriksson; Barbara M. Casari; Langer, Vratislav
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 4
• Pages of publication: i40 - i42
• a: 7.3868 ± 0.0003 Å
• b: 17.1107 ± 0.0007 Å
• c: 7.9848 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1009.23 ± 0.08 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 63
• Hermann-Mauguin space group symbol: C m c m
• Hall space group symbol: -C 2c 2
• Residual factor for all reflections: 0.0749
• Residual factor for significantly intense reflections: 0.0498
• Weighted residual factors for significantly intense reflections: 0.1355
• Weighted residual factors for all reflections included in the refinement: 0.1508
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes