Information card for entry 2007234

Structure parameters

• Chemical name: Disodium bis(methyl-α-D-mannopyranosidato(3-)) 5/3-bismutate(III) hydroxide dodecahydrate
• Formula: C14 H47 Bi1.6667 Na2 O25
• Calculated formula: C14 H22.6667 Bi1.66667 Na2 O25.0467
• Title of publication: Polyol‒Metal Complexes. 26. A Three-Dimensional Triply-Connected Alkoxo‒Metal Net in a Carbohydrate‒Bismuth(III) Complex
• Authors of publication: Klüfers, Peter; Mayer, Peter
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 5
• Pages of publication: 583 - 586
• a: 21.2245 ± 0.0011 Å
• b: 21.2245 ± 0.0011 Å
• c: 21.2245 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9561.2 ± 0.9 ų
• Cell temperature: 250 ± 2 K
• Ambient diffraction temperature: 250 ± 2 K
• Number of distinct elements: 5
• 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: 0.026
• Residual factor for significantly intense reflections: 0.022
• Weighted residual factors for all reflections: 0.043
• Weighted residual factors for significantly intense reflections: 0.042
• Goodness-of-fit parameter for all reflections: 0.983
• Goodness-of-fit parameter for significantly intense reflections: 1.006
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKa
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No