Information card for entry 7008763

Structure parameters

• Formula: C45 H85.5 Cu3.5 N9 Na1.5 O63 P W10.5
• Calculated formula: C40 H32 Cu3.56 N8 O46 P W10.56
• Title of publication: Molecular and multidimensional polyoxotungstates functionalized by {Cu(bpy)}2+ groups.
• Authors of publication: Lisnard, Laurent; Dolbecq, Anne; Mialane, Pierre; Marrot, Jérôme; Codjovi, Epiphane; Sécheresse, Francis
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 24
• Pages of publication: 3913 - 3920
• a: 18.1584 ± 0.0002 Å
• b: 22.2622 ± 0.0004 Å
• c: 22.3088 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9018.2 ± 0.2 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 8
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.2066
• Residual factor for significantly intense reflections: 0.0968
• Weighted residual factors for significantly intense reflections: 0.2298
• Weighted residual factors for all reflections included in the refinement: 0.2802
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No