Information card for entry 4504758

Structure parameters

• Common name: Ruthenium polypyridyl complex
• Formula: C69.5 H75 Cl4 N20 O14 Ru2
• Calculated formula: C69.5 H63 Cl4 N20 O14 Ru2
• Title of publication: Supramolecular Self-Assembled Ruthenium−Polypyridyl Framework Encapsulating Discrete Water Cluster
• Authors of publication: Deshpande, Megha S.; Kumbhar, Avinash S.; Puranik, Vedavati G.; Selvaraj, K.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2006
• Journal volume: 6
• Journal issue: 3
• Pages of publication: 743
• a: 14.281 ± 0.0006 Å
• b: 21.734 ± 0.0008 Å
• c: 28.367 ± 0.001 Å
• α: 90°
• β: 109.804 ± 0.001°
• γ: 90°
• Cell volume: 8283.9 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.094
• Residual factor for significantly intense reflections: 0.0643
• Weighted residual factors for significantly intense reflections: 0.1791
• Weighted residual factors for all reflections included in the refinement: 0.1974
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No