Information card for entry 1513287

Structure parameters

• Formula: C32 H38 B2 Li Nd O Si
• Calculated formula: C32 H38 B2 Li Nd O Si
• Title of publication: ansa-Bis(fluorenyl)neodymium Catalysts for Cyclocopolymerization of Ethylene with Butadiene
• Authors of publication: Thuilliez, Julien; Ricard, Louis; Nief, François; Boisson, Fernande; Boisson, Christophe
• Journal of publication: Macromolecules
• Year of publication: 2009
• Journal volume: 42
• Journal issue: 11
• Pages of publication: 3774
• a: 10.423 ± 0.001 Å
• b: 14.529 ± 0.001 Å
• c: 19.576 ± 0.001 Å
• α: 90°
• β: 100.85 ± 0.001°
• γ: 90°
• Cell volume: 2911.5 ± 0.4 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 7
• 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: 0.044
• Residual factor for significantly intense reflections: 0.0317
• Weighted residual factors for significantly intense reflections: 0.0796
• Weighted residual factors for all reflections included in the refinement: 0.0841
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No