Information card for entry 7126814

Structure parameters

• Formula: C98 H188 O26 Si16 Yb2
• Calculated formula: C98 H188 O26 Si16 Yb2
• Title of publication: Structure and small molecule activation reactivity of a metallasilsesquioxane of divalent ytterbium.
• Authors of publication: Willauer, Aurélien R; Dabrowska, Anna M.; Scopelliti, Rosario; Mazzanti, Marinella
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 63
• Pages of publication: 8936 - 8939
• a: 16.788 ± 0.003 Å
• b: 30.084 ± 0.005 Å
• c: 25.587 ± 0.003 Å
• α: 90°
• β: 90.57 ± 0.01°
• γ: 90°
• Cell volume: 12922 ± 3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• 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: 0.196
• Residual factor for significantly intense reflections: 0.1206
• Weighted residual factors for significantly intense reflections: 0.2536
• Weighted residual factors for all reflections included in the refinement: 0.2935
• Goodness-of-fit parameter for all reflections included in the refinement: 1.116
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No