Information card for entry 7235258

Structure parameters

• Formula: C40 H38 Br2 Cl0.5 F9 Ir N4 P1.5
• Calculated formula: C40 H38 Br2 Cl0.5 F9 Ir N4 P1.5
• Title of publication: Iridium complex-linked porous organic polymers for recyclable, broad-scope photocatalysis of organic transformations
• Authors of publication: Xu, Zi-Yue; Luo, Yi; Zhang, Dan-Wei; Wang, Hui; Sun, Xing-Wen; Li, Zhan-Ting
• Journal of publication: Green Chemistry
• Year of publication: 2020
• Journal volume: 22
• Journal issue: 1
• Pages of publication: 136 - 143
• a: 11.3884 ± 0.0014 Å
• b: 14.5156 ± 0.0018 Å
• c: 14.8459 ± 0.0017 Å
• α: 90°
• β: 105.062 ± 0.005°
• γ: 90°
• Cell volume: 2369.9 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0762
• Residual factor for significantly intense reflections: 0.0623
• Weighted residual factors for significantly intense reflections: 0.1864
• Weighted residual factors for all reflections included in the refinement: 0.2044
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 1.34138 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No