Information card for entry 1576132

Structure parameters

• Formula: C14 H14 N4 O2
• Calculated formula: C14 H14 N4 O2
• 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: 7.29001 ± 0.00008 Å
• b: 24.7363 ± 0.0002 Å
• c: 7.53443 ± 0.00008 Å
• α: 90°
• β: 113.324 ± 0.0013°
• γ: 90°
• Cell volume: 1247.64 ± 0.02 ų
• Cell temperature: 173.01 ± 0.1 K
• Ambient diffraction temperature: 173.01 ± 0.1 K
• Number of distinct elements: 4
• 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: 0.0329
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.0845
• Weighted residual factors for all reflections included in the refinement: 0.0851
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No