Information card for entry 1564309

Structure parameters

• Formula: C58 H62 Cl2 N2 Pd
• Calculated formula: C58 H62 Cl2 N2 Pd
• Title of publication: The synergistic effect of rigid and flexible substituents on insertion polymerization with α-diimine nickel and palladium catalysts
• Authors of publication: Hai, Zijuan; Lu, Zhou; Li, Shuaikang; Cao, Zhong-Yan; Dai, Shengyu
• Journal of publication: Polymer Chemistry
• Year of publication: 2021
• Journal volume: 12
• Journal issue: 32
• Pages of publication: 4643 - 4653
• a: 11.0865 ± 0.0011 Å
• b: 24.739 ± 0.002 Å
• c: 18.0106 ± 0.0017 Å
• α: 90°
• β: 100.813 ± 0.002°
• γ: 90°
• Cell volume: 4852 ± 0.8 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• 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: 0.1101
• Residual factor for significantly intense reflections: 0.0749
• Weighted residual factors for significantly intense reflections: 0.2027
• Weighted residual factors for all reflections included in the refinement: 0.2311
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No