Information card for entry 4066055

Structure parameters

• Formula: C30 H25 Cl F4 P Rh
• Calculated formula: C30 H25 Cl F4 P Rh
• SMILES: [Rh]123(Cl)([P](c4cccc5c(F)c(F)c(F)c(F)c45)(c4ccccc4)c4ccccc4)[CH]4=[CH]2CC[CH]3=[CH]1CC4
• Title of publication: Remote C−F−Metal Interactions in Late-Transition-Metal Complexes
• Authors of publication: Stanek, Kyrill; Czarniecki, Barbara; Aardoom, Raphael; Rüegger, Heinz; Togni, Antonio
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 11
• Pages of publication: 2540
• a: 11.6216 ± 0.0007 Å
• b: 14.2972 ± 0.0009 Å
• c: 15.6137 ± 0.001 Å
• α: 90°
• β: 100.768 ± 0.002°
• γ: 90°
• Cell volume: 2548.6 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0437
• Residual factor for significantly intense reflections: 0.0364
• Weighted residual factors for significantly intense reflections: 0.0829
• Weighted residual factors for all reflections included in the refinement: 0.0862
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No