Information card for entry 7702516

Structure parameters

• Common name: 00001
• Formula: C96 H177 Li2 O25 Si16 Sm
• Calculated formula: C96 H160 Li2 O25 Si16 Sm
• Title of publication: A functional model for lanthanide doped silicate materials: synthesis of an apically substituted samarium silsesquioxane complex
• Authors of publication: Arnold, Polly L.; Blake, Alexander J.; Hall, Sarah N.; Ward, Benjamin D.; Wilson, Claire
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2001
• Journal issue: 4
• Pages of publication: 488
• a: 17.54 ± 0.002 Å
• b: 31.945 ± 0.003 Å
• c: 21.3 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 11935 ± 2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.112
• Residual factor for significantly intense reflections: 0.0766
• Weighted residual factors for significantly intense reflections: 0.175
• Weighted residual factors for all reflections included in the refinement: 0.199
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No