Information card for entry 7057643

Structure parameters

• Formula: C17 H9 Br N O10 Ru3
• Calculated formula: C17 H9 Br N O10 Ru3
• Title of publication: Ruthenium carbonyl complexes with pyridine-alkoxide ligands: synthesis, characterization and catalytic application in dehydrogenative oxidation of alcohols
• Authors of publication: Hao, Zhiqiang; Yan, Xinlong; Liu, Kang; Yue, Xiaohui; Han, Zhangang; Lin, Jin
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 18
• Pages of publication: 15472
• a: 8.9466 ± 0.0009 Å
• b: 17.8612 ± 0.0019 Å
• c: 14.6199 ± 0.0016 Å
• α: 90°
• β: 96.403 ± 0.002°
• γ: 90°
• Cell volume: 2321.6 ± 0.4 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 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: 0.0475
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.1176
• Weighted residual factors for all reflections included in the refinement: 0.1274
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No