Information card for entry 2209130

Structure parameters

• Chemical name: poly[tri-μ~3~-acetylacetonato-pytidinetrisodium(I)]
• Formula: C20 H26 N Na3 O6
• Calculated formula: C20 H26 N Na3 O6
• SMILES: [Na+].[Na+].[Na+].O=C(C)C=C([O-])C.O=C(C)C=C([O-])C.O=C(C)C=C([O-])C.n1ccccc1
• Title of publication: Poly[μ~4~-acetylacetonato-di-μ~3~-acetylacetonato-pyridinetrisodium(I)]
• Authors of publication: Salmon, Lionel; Thuéry, Pierre; Ephritikhine, Michel
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 6
• Pages of publication: m1250 - m1251
• a: 10.8858 ± 0.0013 Å
• b: 18.969 ± 0.002 Å
• c: 12.1338 ± 0.0012 Å
• α: 90°
• β: 111.941 ± 0.007°
• γ: 90°
• Cell volume: 2324.1 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0837
• Residual factor for significantly intense reflections: 0.0497
• Weighted residual factors for significantly intense reflections: 0.1089
• Weighted residual factors for all reflections included in the refinement: 0.1255
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes