Information card for entry 4127215

Structure parameters

• Formula: C30 H23 F6 Ir N5 P
• Calculated formula: C30 H23 F6 Ir N5 P
• Title of publication: In Situ Visualization of Assembly and Photonic Signal Processing in a Triplet Light-Harvesting Nanosystem.
• Authors of publication: Sun, Meng-Jia; Liu, Yingying; Yan, Yaming; Li, Rui; Shi, Qiang; Zhao, Yong Sheng; Zhong, Yu-Wu; Yao, Jiannian
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2018
• a: 10.887 ± 0.002 Å
• b: 15.832 ± 0.003 Å
• c: 32.699 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5636.1 ± 1.9 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• 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: 0.0925
• Residual factor for significantly intense reflections: 0.0678
• Weighted residual factors for significantly intense reflections: 0.107
• Weighted residual factors for all reflections included in the refinement: 0.116
• Goodness-of-fit parameter for all reflections included in the refinement: 1.221
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No