Information card for entry 7112663

Structure parameters

• Formula: C117.5 H184.5 Bi38 O110.25 S10.75
• Calculated formula: C117.494 H184.5 Bi38 O110.25 S10.75
• Title of publication: Organic-inorganic hybrid materials starting from the novel nanoscaled bismuth oxido methacrylate cluster [Bi38O45(OMc)24(DMSO)9]·2DMSO·7H2O.
• Authors of publication: Miersch, Linda; Rüffer, Tobias; Mehring, Michael
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2011
• Journal volume: 47
• Journal issue: 22
• Pages of publication: 6353 - 6355
• a: 18.372 ± 0.0007 Å
• b: 21.0842 ± 0.001 Å
• c: 30.7821 ± 0.0015 Å
• α: 89.917 ± 0.004°
• β: 86.768 ± 0.004°
• γ: 67.305 ± 0.004°
• Cell volume: 10980.3 ± 0.9 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0539
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for significantly intense reflections: 0.0835
• Weighted residual factors for all reflections included in the refinement: 0.0863
• Goodness-of-fit parameter for all reflections included in the refinement: 0.975
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7106469
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No