Information card for entry 7004909

Structure parameters

• Formula: C23 H43 B2 F8 N2 O3 P Ru
• Calculated formula: C23 H43 B2 F8 N2 O3 P Ru
• Title of publication: Electron-rich, bulky PNN-type ruthenium complexes: synthesis, characterization and catalysis of alcohol dehydrogenation.
• Authors of publication: Zhang, Jing; Gandelman, Mark; Shimon, Linda J. W.; Milstein, David
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 1
• Pages of publication: 107 - 113
• a: 12.53 ± 0.0003 Å
• b: 16.715 ± 0.0004 Å
• c: 29.106 ± 0.0006 Å
• α: 90 ± 0.001°
• β: 90 ± 0.0011°
• γ: 90 ± 0.0011°
• Cell volume: 6095.9 ± 0.2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 8
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0782
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.1039
• Weighted residual factors for all reflections included in the refinement: 0.1122
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No