Information card for entry 7107334

Structure parameters

• Formula: C32 H22 F10 Ir N8 P
• Calculated formula: C32 H22 F10 Ir N8 P
• Title of publication: Reversible piezochromic behavior of two new cationic iridium(III) complexes
• Authors of publication: Guogang Shan; Haibin Li; Hong-Tao Cao; Dong-Xia Zhu; Zhong-Min Su; Yi Liao
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 2000
• a: 18.452 ± 0.005 Å
• b: 18.452 ± 0.005 Å
• c: 41.756 ± 0.005 Å
• α: 90 ± 0.005°
• β: 90 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 14217 ± 6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 110
• Hermann-Mauguin space group symbol: I 41 c d
• Hall space group symbol: I 4bw -2c
• Residual factor for all reflections: 0.0735
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for significantly intense reflections: 0.1063
• Weighted residual factors for all reflections included in the refinement: 0.1179
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No