Information card for entry 7014282

Structure parameters

• Formula: C19 H33 F4 I N O P2 Rh
• Calculated formula: C19 H33 F4 I N O P2 Rh
• SMILES: I[Rh]([P](CC)(CC)CC)([P](CC)(CC)CC)(c1c(F)c(F)nc(F)c1F)C(=O)C
• 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: 32.022 ± 0.003 Å
• b: 8.892 ± 0.0009 Å
• c: 18.852 ± 0.0015 Å
• α: 90°
• β: 111.804 ± 0.007°
• γ: 90°
• Cell volume: 4983.9 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0377
• Residual factor for significantly intense reflections: 0.0231
• Weighted residual factors for significantly intense reflections: 0.0411
• Weighted residual factors for all reflections included in the refinement: 0.0449
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No