Information card for entry 7024473

Structure parameters

• Formula: C49.94 H55.88 Br2 F12 N6 O3 P2 Ru
• Calculated formula: C49.938 H55.876 Br2 F12 N6 O3 P2 Ru
• Title of publication: Synthesis and characterization of regioselective substituted tetrapyridophenazine ligands and their Ru(II) complexes.
• Authors of publication: Karnahl, Michael; Tschierlei, Stefanie; Kuhnt, Christian; Dietzek, Benjamin; Schmitt, Michael; Popp, Jürgen; Schwalbe, Matthias; Krieck, Sven; Görls, Helmar; Heinemann, Frank W.; Rau, Sven
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 9
• Pages of publication: 2359 - 2370
• a: 11.244 ± 0.0007 Å
• b: 16.7226 ± 0.0017 Å
• c: 16.7455 ± 0.0014 Å
• α: 72.255 ± 0.007°
• β: 87.076 ± 0.005°
• γ: 71.488 ± 0.007°
• Cell volume: 2840 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.1357
• Residual factor for significantly intense reflections: 0.0893
• Weighted residual factors for significantly intense reflections: 0.2233
• Weighted residual factors for all reflections included in the refinement: 0.25
• Goodness-of-fit parameter for all reflections included in the refinement: 1.11
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No