Information card for entry 2008726

Structure parameters

• Chemical name: Ruthenium(II)-tris(bipyridine)-sodium(I)-tris(μ-oxalato)aluminate(III)
• Formula: C36 H24 Al N6 Na O12 Ru
• Calculated formula: C36 H24 Al N6 Na O12 Ru
• SMILES: [Al]123(OC(=O)C(=O)O1)(OC(=O)C(=O)O2)OC(=O)C(=O)O3.c12cccc[n]1[Ru]13([n]4c(cccc4)c4cccc[n]14)([n]1c(cccc1)c1cccc[n]31)[n]1c2cccc1.[Na+]
• 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: 15.407 ± 0.004 Å
• b: 15.407 ± 0.004 Å
• c: 15.407 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3657.2 ± 1.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• 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: 0.099
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for all reflections included in the refinement: 0.107
• Goodness-of-fit parameter for all reflections included in the refinement: 1.145
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No