Information card for entry 1576131

Structure parameters

• Formula: C16 H20 F12 N4 O2 P2
• Calculated formula: C16 H20 F12 N4 O2 P2
• Title of publication: Tunable bis(pyridinium amidate) ligands efficiently promote palladium-catalyzed ethylene polymerization
• Authors of publication: Reusser, Esaïe; Albrecht, Martin
• Journal of publication: Catalysis Science & Technology
• Year of publication: 2025
• a: 7.13858 ± 0.00007 Å
• b: 21.77525 ± 0.00016 Å
• c: 7.76094 ± 0.00008 Å
• α: 90°
• β: 108.082 ± 0.0011°
• γ: 90°
• Cell volume: 1146.81 ± 0.02 ų
• Cell temperature: 173.1 ± 0.5 K
• Ambient diffraction temperature: 173.1 ± 0.5 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: 0.0369
• Residual factor for significantly intense reflections: 0.0364
• Weighted residual factors for significantly intense reflections: 0.0958
• Weighted residual factors for all reflections included in the refinement: 0.0962
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No