Information card for entry 4349267

Structure parameters

• Formula: C28 H18 Cl5 N8 O6 Ru
• Calculated formula: C28 H18 Cl5 N8 O6 Ru
• SMILES: c12ccccc2[N]([Ru]23([N]1=O)([N](c1c(cccc1Cl)Cl)=Nc1[n]2cccc1)[N](c1c(cccc1Cl)Cl)=Nc1[n]3cccc1)=O.[O-]Cl(=O)(=O)=O
• Title of publication: Ruthenium Derivatives of in Situ Generated Redox-Active 1,2-Dinitrosobenzene and 2-Nitrosoanilido. Diverse Structural and Electronic Forms.
• Authors of publication: Ghosh, Prabir; Banerjee, Soumyodip; Lahiri, Goutam Kumar
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 24
• Pages of publication: 12832 - 12843
• a: 23.665 ± 0.012 Å
• b: 8.326 ± 0.004 Å
• c: 18.241 ± 0.011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3594 ± 3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 52
• Hermann-Mauguin space group symbol: P n n a
• Hall space group symbol: -P 2a 2bc
• Residual factor for all reflections: 0.0935
• Residual factor for significantly intense reflections: 0.0864
• Weighted residual factors for significantly intense reflections: 0.2329
• Weighted residual factors for all reflections included in the refinement: 0.2408
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 1.5419 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No