Information card for entry 2019653

Structure parameters

• Chemical name: [(1<i>R</i>,1'<i>R</i>,2<i>R</i>,2'<i>R</i>)-2,2'-Bis(diphenylphosphanyl)-1,1'-dicyclopentane][η^4^-(<i>Z</i>,<i>Z</i>)-cycloocta-1,5-diene]rhodium(I) tetrafluoroborate dichloromethane monosolvate
• Formula: C43 H50 B Cl2 F4 P2 Rh
• Calculated formula: C43 H50 B Cl2 F4 P2 Rh
• Title of publication: Two precatalysts for application in asymmetric homogeneous hydrogenation
• Authors of publication: Meißner, Antje; Pribbenow, Cornelia; Drexler, Hans-Joachim; Heller, Detlef
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 10
• Pages of publication: 941 - 944
• a: 10.2285 ± 0.0002 Å
• b: 13.9823 ± 0.0003 Å
• c: 14.5131 ± 0.0004 Å
• α: 90°
• β: 108.265 ± 0.0012°
• γ: 90°
• Cell volume: 1971.06 ± 0.08 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0215
• Residual factor for significantly intense reflections: 0.0201
• Weighted residual factors for significantly intense reflections: 0.0474
• Weighted residual factors for all reflections included in the refinement: 0.0481
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes