Information card for entry 1569747

Structure parameters

• Formula: C74 H102 O6 P2 Pd2
• Calculated formula: C74 H102 O6 P2 Pd2
• Title of publication: Suzuki–Miyaura catalyst-transfer polymerization: new mechanistic insights
• Authors of publication: Howell, Mitchell T.; Kei, Peter; Anokhin, Maksim V.; Losovyj, Yaroslav; Fronczek, Frank R.; Nesterov, Evgueni E.
• Journal of publication: Polymer Chemistry
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 37
• Pages of publication: 4319 - 4337
• a: 15.27 ± 0.0009 Å
• b: 16.0942 ± 0.0009 Å
• c: 28.5954 ± 0.0017 Å
• α: 90°
• β: 102.271 ± 0.002°
• γ: 90°
• Cell volume: 6867 ± 0.7 ų
• Cell temperature: 100 ± 0.5 K
• Ambient diffraction temperature: 100 ± 0.5 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.075
• Residual factor for significantly intense reflections: 0.0478
• Weighted residual factors for significantly intense reflections: 0.0885
• Weighted residual factors for all reflections included in the refinement: 0.0972
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No