Information card for entry 4311387

Structure parameters

• Formula: C21 H18 Cl2 N5 O0.5 Ru
• Calculated formula: C21 H18 Cl2 N5 O0.5 Ru
• Title of publication: Coordination of 9-Ethylguanine to the Mixed-Ligand Compound α-[Ru(azpy)(bpy)Cl~2~] (azpy = 2-phenylazopyridine and bpy = 2,2'-Bipyridine). An Unprecedented Ligand Positional Shift, Correlated to the Cytotoxicity of This Type of [RuL~2~Cl~2~] (with L = azpy or bpy) Complex
• Authors of publication: Anna C. G. Hotze; Erwin P. L. van der Geer; Sabrine E. Caspers; Huub Kooijman; Anthony L. Spek; Jaap G. Haasnoot; Jan Reedijk
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 4935 - 4943
• a: 36.056 ± 0.004 Å
• b: 7.9181 ± 0.001 Å
• c: 16.039 ± 0.002 Å
• α: 90°
• β: 116.099 ± 0.01°
• γ: 90°
• Cell volume: 4112.2 ± 0.9 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.0476
• Residual factor for significantly intense reflections: 0.0296
• Weighted residual factors for significantly intense reflections: 0.0606
• Weighted residual factors for all reflections included in the refinement: 0.0657
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No