Information card for entry 2008724

Structure parameters

• Chemical name: Ruthenium(II)-tris(bipyridine)-sodium(I)-tris(μ-oxalato)ruthenate(III)
• Formula: C36 H24 N6 Na O12 Ru2
• Calculated formula: C36 H24 N6 Na O12 Ru2
• SMILES: c12cccc[n]1[Ru]13([n]4c(cccc4)c4cccc[n]14)([n]1c(cccc1)c1cccc[n]31)[n]1c2cccc1.[Na+].C1(=O)O[Ru]23(OC(=O)C(=O)O2)(OC1=O)OC(=O)C(=O)O3
• Title of publication: Three anionic polymeric networks: sodium(I)‒ruthenium(III), sodium(I)‒rhodium(III) and sodium(I)‒aluminium(III) μ-oxalato complexes with tris(2,2'-bipyridine)ruthenium(II) cations
• Authors of publication: Pellaux, Rene; Decurtins, Silvio; Schmalle, Helmut W.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 7
• Pages of publication: 1075 - 1079
• a: 15.556 ± 0.0012 Å
• b: 15.556 ± 0.0012 Å
• c: 15.556 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3764.4 ± 0.5 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 6
• Space group number: 198
• Hermann-Mauguin space group symbol: P 21 3
• Hall space group symbol: P 2ac 2ab 3
• Residual factor for all reflections: 0.039
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for all reflections included in the refinement: 0.063
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No