Information card for entry 4347863

Structure parameters

• Formula: C54 H40 Cl2 N10 O10 Ru2
• Calculated formula: C54 H40 Cl2 N10 O10 Ru2
• SMILES: c12cccc3c4c5c(cccc5c(c23)O[Ru]23(N1)([n]1ccccc1c1[n]2cccc1)[n]1ccccc1c1[n]3cccc1)N[Ru]12(O4)([n]3ccccc3c3[n]1cccc3)[n]1ccccc1c1[n]2cccc1.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O
• Title of publication: 1,5-Diamido-9,10-anthraquinone, a Centrosymmetric Redox-Active Bridge with Two Coupled β-Ketiminato Chelate Functions: Symmetric and Asymmetric Diruthenium Complexes.
• Authors of publication: Ansari, Mohd Asif; Mandal, Abhishek; Paretzki, Alexa; Beyer, Katharina; Fiedler, Jan; Kaim, Wolfgang; Lahiri, Goutam Kumar
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 11
• Pages of publication: 5655 - 5670
• a: 12.451 ± 0.005 Å
• b: 13.288 ± 0.006 Å
• c: 18.535 ± 0.008 Å
• α: 90°
• β: 90.214 ± 0.006°
• γ: 90°
• Cell volume: 3067 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0948
• Residual factor for significantly intense reflections: 0.0788
• Weighted residual factors for significantly intense reflections: 0.1994
• Weighted residual factors for all reflections included in the refinement: 0.2113
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No