Information card for entry 7234624

Structure parameters

• Formula: C60 H66 F6 Ir N6 P
• Calculated formula: C60 H66 F6 Ir N6 P
• Title of publication: AIE-active Ir(iii) complexes with tunable emissions, mechanoluminescence and their application for data security protection
• Authors of publication: Zhongming Song; Rui Liu; Yuhao Li; Hong Shi; Jinyang Hu; Xiao Cai; Hongjun Zhu
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2016
• Journal volume: 4
• Pages of publication: 2553 - 2559
• a: 9.304 ± 0.0019 Å
• b: 16.24 ± 0.003 Å
• c: 19.48 ± 0.004 Å
• α: 72.15 ± 0.03°
• β: 85.46 ± 0.03°
• γ: 89.18 ± 0.03°
• Cell volume: 2792.7 ± 1.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0985
• Residual factor for significantly intense reflections: 0.0671
• Weighted residual factors for significantly intense reflections: 0.1529
• Weighted residual factors for all reflections included in the refinement: 0.1689
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No