Information card for entry 7014278

Structure parameters

• Formula: C23 H45 F4 N P3 Rh
• Calculated formula: C23 H45 F4 N P3 Rh
• SMILES: [Rh]([P](CC)(CC)CC)([P](CC)(CC)CC)([P](CC)(CC)CC)c1c(F)c(nc(F)c1F)F
• Title of publication: C-F or C-H bond activation and C-C coupling reactions of fluorinated pyridines at rhodium: synthesis, structure and reactivity of a variety of tetrafluoropyridyl complexes.
• Authors of publication: Noveski, Daniel; Braun, Thomas; Neumann, Beate; Stammler, Anja; Stammler, Hans-Georg
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2004
• Journal issue: 24
• Pages of publication: 4106 - 4119
• a: 15.351 ± 0.0001 Å
• b: 10.443 ± 0.0001 Å
• c: 17.944 ± 0.0002 Å
• α: 90°
• β: 99.274 ± 0.0004°
• γ: 90°
• Cell volume: 2839.01 ± 0.05 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: 0.0337
• Residual factor for significantly intense reflections: 0.025
• Weighted residual factors for significantly intense reflections: 0.0569
• Weighted residual factors for all reflections included in the refinement: 0.0601
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No