Information card for entry 4349265

Structure parameters

• Formula: C34 H26 Cl5 N8 O7 Ru
• Calculated formula: C34 H26 Cl5 N8 O7 Ru
• SMILES: [Ru]123([N](=O)c4ccccc4[N]1=O)([N](=Nc1[n]2cccc1)c1c(Cl)cccc1Cl)[N](=Nc1[n]3cccc1)c1c(Cl)cccc1Cl.Cl(=O)(=O)(=O)[O-].O.c1ccccc1
• 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: 10.4299 ± 0.0003 Å
• b: 13.0194 ± 0.0003 Å
• c: 27.5903 ± 0.001 Å
• α: 90°
• β: 96.489 ± 0.003°
• γ: 90°
• Cell volume: 3722.51 ± 0.19 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0628
• Residual factor for significantly intense reflections: 0.05
• Weighted residual factors for significantly intense reflections: 0.1182
• Weighted residual factors for all reflections included in the refinement: 0.128
• Goodness-of-fit parameter for all reflections included in the refinement: 0.995
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No