Information card for entry 4070884

Structure parameters

• Common name: yw242 (R,Rp)-1i
• Formula: C51 H39 Cl11 F12 Fe O2 P2 Pd
• Calculated formula: C51 H39 Cl11 F12 Fe O2 P2 Pd
• Title of publication: Synthesis, Coordination Behavior, and Use in Asymmetric Hydrogenations of Walphos-Type Ligands
• Authors of publication: Wang, Yaping; Sturm, Thomas; Steurer, Marianne; Arion, Vladimir B.; Mereiter, Kurt; Spindler, Felix; Weissensteiner, Walter
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 6
• Pages of publication: 1119
• a: 10.4499 ± 0.0004 Å
• b: 23.0779 ± 0.0011 Å
• c: 24.5543 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5921.6 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0451
• Residual factor for significantly intense reflections: 0.0363
• Weighted residual factors for significantly intense reflections: 0.0771
• Weighted residual factors for all reflections included in the refinement: 0.0808
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No