Information card for entry 4068259

Structure parameters

• Formula: C55 H42 Cl2 F3 O3 P3 Pt S
• Calculated formula: C55 H42 Cl2 F3 O3 P3 Pt S
• Title of publication: Switching on the Phosphorescence of Pyrene by Cycloplatination
• Authors of publication: Hu, Jian; Yip, John H. K.; Ma, Dik-Lung; Wong, Kwok-Yin; Chung, Wai-Hong
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 1
• Pages of publication: 51
• a: 13.5802 ± 0.0006 Å
• b: 17.4404 ± 0.0008 Å
• c: 21.2316 ± 0.0009 Å
• α: 90°
• β: 106.64 ± 0.001°
• γ: 90°
• Cell volume: 4818 ± 0.4 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0372
• Residual factor for significantly intense reflections: 0.0302
• Weighted residual factors for significantly intense reflections: 0.0772
• Weighted residual factors for all reflections included in the refinement: 0.0803
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No