Information card for entry 7024471

Structure parameters

• Formula: C64.5 H67 Br2 F12 N10 O1.5 P2 Ru
• Calculated formula: C64.5 H67 Br2 F12 N10 O1.5 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: 10.3267 ± 0.0005 Å
• b: 18.3922 ± 0.0012 Å
• c: 20.7064 ± 0.0013 Å
• α: 96.501 ± 0.002°
• β: 102.542 ± 0.004°
• γ: 106.29 ± 0.004°
• Cell volume: 3620.6 ± 0.4 ų
• Cell temperature: 183 ± 2 K
• Ambient diffraction temperature: 183 ± 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: 0.174
• Residual factor for significantly intense reflections: 0.0906
• Weighted residual factors for significantly intense reflections: 0.2126
• Weighted residual factors for all reflections included in the refinement: 0.262
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No