Information card for entry 4332033

Structure parameters

• Chemical name: (1,3-bis(phenyl)triazenido-N,N')tetrakis{triethoxyphosphine}ruthenium(II) tetraphenylborate
• Formula: C60 H90 B N3 O12 P4 Ru
• Calculated formula: C60 H90 B N3 O12 P4 Ru
• SMILES: [Ru]1([P](OCC)(OCC)OCC)([P](OCC)(OCC)OCC)([P](OCC)(OCC)OCC)([P](OCC)(OCC)OCC)[N](=NN1c1ccccc1)c1ccccc1.[B-](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Synthesis and Characterization of Triazenide and Triazene Complexes of Ruthenium and Osmium
• Authors of publication: Albertin, Gabriele; Antoniutti, Stefano; Bedin, Marco; Castro, Jesús; Garcia-Fontán, Soledad
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 9
• Pages of publication: 3816 - 3825
• a: 12.5801 ± 0.0013 Å
• b: 14.8211 ± 0.0016 Å
• c: 18.7249 ± 0.0019 Å
• α: 88.894 ± 0.002°
• β: 85.266 ± 0.002°
• γ: 75.55 ± 0.002°
• Cell volume: 3369.3 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1088
• Residual factor for significantly intense reflections: 0.0506
• Weighted residual factors for significantly intense reflections: 0.0945
• Weighted residual factors for all reflections included in the refinement: 0.1078
• Goodness-of-fit parameter for all reflections included in the refinement: 0.821
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No