Information card for entry 1568884

Structure parameters

• Formula: C50 H66 Al O2 P
• Calculated formula: C50 H66 Al O2 P
• SMILES: [P+](C[Al](Oc1c(C(C)(C)C)cc(C)cc1C(C)(C)C)(Oc1c(C(C)(C)C)cc(C)cc1C(C)(C)C)C)(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Phosphonium ylide/organoaluminum-based Lewis pairs for the highly efficient living/controlled polymerization of alkyl (meth)acrylates
• Authors of publication: Chen, Zhikang; Zhao, Wuchao; Liu, Conglei; Jiang, Liuying; Fu, Gang; Zhang, Yuetao; Zhu, Hongping
• Journal of publication: Polymer Chemistry
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 19
• Pages of publication: 2344 - 2354
• a: 17.4083 ± 0.0003 Å
• b: 18.0287 ± 0.0004 Å
• c: 28.2153 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8855.3 ± 0.3 ų
• Cell temperature: 101 ± 2 K
• Ambient diffraction temperature: 101.15 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0367
• Residual factor for significantly intense reflections: 0.0345
• Weighted residual factors for significantly intense reflections: 0.0912
• Weighted residual factors for all reflections included in the refinement: 0.0927
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No