Information card for entry 7010869

Structure parameters

• Formula: C56 H48 F6 N P3 Ru
• Calculated formula: C56 H48 F6 N P3 Ru
• SMILES: [Ru]1234([P](c5ccccc5)(c5ccccc5)c5ccccc5)([P](c5ccccc5)(c5ccccc5)c5ccccc5)([N]#CC(Cc5ccccc5)c5ccccc5)[cH]5[cH]4[cH]3[cH]2[cH]15.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Reactions of ruthenium cyclopropenyl complexes with trimethylsilyl azide
• Authors of publication: Chang, Ku-Hsien; Lin, Ying-Chih; Liu, Yi-Hong; Wang, Yu
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2001
• Journal issue: 21
• Pages of publication: 3154
• a: 11.064 ± 0.0001 Å
• b: 25.2988 ± 0.0004 Å
• c: 18.4569 ± 0.0001 Å
• α: 90°
• β: 95.915 ± 0.001°
• γ: 90°
• Cell volume: 5138.69 ± 0.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• 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: 0.0939
• Residual factor for significantly intense reflections: 0.0643
• Weighted residual factors for all reflections: 0.1914
• Weighted residual factors for significantly intense reflections: 0.1728
• Goodness-of-fit parameter for all reflections: 1.263
• Goodness-of-fit parameter for significantly intense reflections: 1.344
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No