Information card for entry 4308637

Structure parameters

• Formula: C46 H32 Cl2 F6 N6 O P Ru2
• Calculated formula: C46 H32 Cl2 F6 N6 O P Ru2
• SMILES: [Ru]12(Cl)([n]3c4c(ccc3)ccc3ccc[n]1c43)(O[Ru]13(Cl)([n]4c5c6[n]1cccc6ccc5ccc4)[n]1c(c4c3cccc4)cccc1)[n]1c(c3ccccc23)cccc1.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Synthesis, Characterization, and Electrochemistry of Biorelevant Photosensitive Low-Potential Orthometalated Ruthenium Complexes
• Authors of publication: Alexander D. Ryabov; Ronan Le Lagadec; Hebert Estevez; Ruben A. Toscano; Simon Hernandez; Larissa Alexandrova; Viktoria S. Kurova; Andreas Fischer; Claude Sirlin; Michel Pfeffer
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 1626 - 1634
• a: 11.531 ± 0.0011 Å
• b: 12.2622 ± 0.0012 Å
• c: 17.186 ± 0.002 Å
• α: 93.533 ± 0.004°
• β: 94.226 ± 0.004°
• γ: 103.916 ± 0.004°
• Cell volume: 2344.4 ± 0.4 ų
• Cell temperature: 223 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1316
• Residual factor for significantly intense reflections: 0.0897
• Weighted residual factors for significantly intense reflections: 0.1856
• Weighted residual factors for all reflections included in the refinement: 0.2058
• Goodness-of-fit parameter for all reflections included in the refinement: 1.149
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No