Information card for entry 4347862

Structure parameters

• Formula: C58 H44 Cl2 N14 O10 Ru2
• Calculated formula: C58 H44 Cl2 N14 O10 Ru2
• SMILES: [Ru]123(Oc4c5cccc6N[Ru]78(Oc(c9c4c(N1)ccc9)c56)([N](=Nc1[n]7cccc1)c1ccccc1)[N](=Nc1[n]8cccc1)c1ccccc1)([N](=Nc1[n]3cccc1)c1ccccc1)[N](=Nc1[n]2cccc1)c1ccccc1.Cl(=O)(=O)(=O)[O-].Cl(=O)(=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: 25.508 ± 0.008 Å
• b: 19.588 ± 0.006 Å
• c: 27.68 ± 0.009 Å
• α: 90°
• β: 99.425 ± 0.005°
• γ: 90°
• Cell volume: 13644 ± 7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0877
• Residual factor for significantly intense reflections: 0.0744
• Weighted residual factors for significantly intense reflections: 0.1922
• Weighted residual factors for all reflections included in the refinement: 0.2049
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No