Information card for entry 7044456

Structure parameters

• Formula: C96 H44 B4 Cl4 F72 N4 O6 Sr2
• Calculated formula: C96 H44 B4 Cl4 F72 N4 O6 Sr2
• Title of publication: Tethered cationic alkaline earth - olefin complexes
• Authors of publication: Rosca, Sorin-Claudiu; Dorcet, Vincent; Roisnel, Thierry; Carpentier, Jean-Francois; Sarazin, Yann
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 11.8244 ± 0.0012 Å
• b: 14.3892 ± 0.0014 Å
• c: 31.655 ± 0.003 Å
• α: 90°
• β: 93.679 ± 0.003°
• γ: 90°
• Cell volume: 5374.8 ± 0.9 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.2113
• Residual factor for significantly intense reflections: 0.088
• Weighted residual factors for significantly intense reflections: 0.1961
• Weighted residual factors for all reflections included in the refinement: 0.2312
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No