Information card for entry 4311256

Structure parameters

• Formula: C58 H66 B2 N8 O3 P2 Ru
• Calculated formula: C58 H66 B2 N8 O3 P2 Ru
• SMILES: [Ru]12([NH2]NC)([P](OCC)(OCC)OCC)([P](c3ccccc3)(c3ccccc3)c3ccccc3)[n]3n([BH](n4[n]1ccc4)n1[n]2ccc1)ccc3.[B-](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Ruthenium Tris(pyrazolyl)borate Diazo Complexes: Preparation of Aryldiazenido, Aryldiazene, and Hydrazine Derivatives
• Authors of publication: Gabriele Albertin; Stefano Antoniutti; Marco Bortoluzzi; Jesus Castro-Fojo; Soledad García-Fontán
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 4511 - 4522
• a: 14.2119 ± 0.0019 Å
• b: 27.294 ± 0.004 Å
• c: 29.49 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 11439 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.306
• Residual factor for significantly intense reflections: 0.0447
• Weighted residual factors for significantly intense reflections: 0.0439
• Weighted residual factors for all reflections included in the refinement: 0.0839
• Goodness-of-fit parameter for all reflections included in the refinement: 0.68
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No