Information card for entry 4322039

Structure parameters

• Formula: Bi2 Co1.66 Na8.8 O102 W20.34
• Calculated formula: Bi2 Co1.66 Na8.8 O102 W20.34
• SMILES: [Bi]12[O]34[W]567(=O)O[W]89%10(=O)[O][W]%113(O6)(=O)O[W]34(O7)(=O)[O][W]467([O]%121[W]1(=O)(O5)(O4)O[W]45([O]28[W]28(O%10)(O5)=[O][Co]5([OH2])([OH2])([O]=[W]%10%13%14([O]%15%16[Bi]%17[O]%18%19[W]%20%21%22(O[W]%23%24%18(=O)O[W]%18%19(=O)(O[W]%19%25([O]%26%17[W](O%19)(O%14)(O[W]%26(O%25)(O%18)(=O)O[W](O%11)(O2)(O%22)(=O)=O)(=O)=[O]5)(=O)O[W]%15(=O)(O%23)(O[W]%16(O%24)(O%13)(=O)O[W](O%21)(O[W]%12(O6)(O1)(O4)=O)(O8)(=O)=O)O%10)O%20)=[O][Co]([O]=3)([O]=7)([OH2])([OH2])[OH2])=O)[OH2])(=O)O9)=O.[Na+].O.O.[Na+].O.O.O.[Na+].O.[Na+].O.[Na+].O.O.O.[Na+].O.O.O.O.O.O.[Na+].O.[Na+].O.O.O.[Na+].O.O.O.O.O.O
• Title of publication: Heteropolymetalate Clusters of the Subvalent Main Group Elements BiIII and SbIII
• Authors of publication: Ina Loose; Elisabeth Droste; Michael Bösing; Heinrich Pohlmann; Michael H. Dickman; Cristina Rosu; Michael T. Pope; Bernt Krebs
• Journal of publication: Inorganic Chemistry
• Year of publication: 1999
• Journal volume: 38
• Pages of publication: 2688 - 2694
• a: 12.583 ± 0.0001 Å
• b: 26.4969 ± 0.0001 Å
• c: 12.8111 ± 0.0001 Å
• α: 90°
• β: 93.0076 ± 0.0004°
• γ: 90°
• Cell volume: 4265.47 ± 0.05 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0753
• Residual factor for significantly intense reflections: 0.0527
• Weighted residual factors for all reflections: 0.1164
• Weighted residual factors for significantly intense reflections: 0.1082
• Goodness-of-fit parameter for all reflections: 1.109
• Goodness-of-fit parameter for significantly intense reflections: 1.159
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No