Information card for entry 7104425

Structure parameters

• Formula: C28 H118 Cu6 Gd2 N24 O108 Si2 W22
• Calculated formula: C28 H94 Cu6 Gd2 N24 O96.52 Si2 W22
• Title of publication: Heterometallic 3d-4f cubane clusters inserted in polyoxometalate matrices.
• Authors of publication: Nohra, Brigitte; Mialane, Pierre; Dolbecq, Anne; Rivière, Eric; Marrot, Jérôme; Sécheresse, Francis
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 19
• Pages of publication: 2703 - 2705
• a: 22.3533 ± 0.001 Å
• b: 12.1726 ± 0.0006 Å
• c: 23.0083 ± 0.0011 Å
• α: 90°
• β: 95.625 ± 0.001°
• γ: 90°
• Cell volume: 6230.4 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1294
• Residual factor for significantly intense reflections: 0.0758
• Weighted residual factors for significantly intense reflections: 0.1754
• Weighted residual factors for all reflections included in the refinement: 0.205
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No