Information card for entry 4334042

Structure parameters

• Formula: C24 H36 N2 Ru Si
• Calculated formula: C24 H36 N2 Ru Si
• SMILES: C[Si]1(C)[Ru]23456([CH]7=[CH]2CC[CH]3=[CH]4CC7)(C2[CH]5=[CH]6C=CCCC2)[n]2ccccc2N1C
• Title of publication: Step-by-Step Introduction of Silazane Moieties at Ruthenium: Different Extents of Ru-H-Si Bond Activation
• Authors of publication: Katharine A. Smart; Mary Grellier; Laure Vendier; Sax A. Mason; Silvia C. Capelli; Alberto Albinati; Sylviane Sabo-Etienne
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 2654 - 2661
• a: 14.247 ± 0.001 Å
• b: 16.073 ± 0.001 Å
• c: 19.43 ± 0.001 Å
• α: 90°
• β: 101.564 ± 0.01°
• γ: 90°
• Cell volume: 4359 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.108
• Residual factor for significantly intense reflections: 0.0424
• Weighted residual factors for significantly intense reflections: 0.068
• Weighted residual factors for all reflections included in the refinement: 0.0817
• Goodness-of-fit parameter for all reflections included in the refinement: 0.986
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No