Information card for entry 7045900

Structure parameters

• Formula: C15 H26 Cl2 O P Ru
• Calculated formula: C15 H26 Cl2 O P Ru
• Title of publication: Synthesis and coordination chemistry of enantiopure t-BuMeP(O)H.
• Authors of publication: Gallen, Albert; Orgué, Sílvia; Muller, Guillermo; Escudero-Adán, Eduardo C; Riera, Antoni; Verdaguer, Xavier; Grabulosa, Arnald
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 15
• Pages of publication: 5366 - 5379
• a: 10.3177 ± 0.0004 Å
• b: 12.7035 ± 0.0004 Å
• c: 15.0982 ± 0.0006 Å
• α: 85.9475 ± 0.0012°
• β: 81.7449 ± 0.0012°
• γ: 71.2831 ± 0.001°
• Cell volume: 1854.22 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0492
• Residual factor for significantly intense reflections: 0.0375
• Weighted residual factors for significantly intense reflections: 0.0891
• Weighted residual factors for all reflections included in the refinement: 0.0984
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No