Information card for entry 4104273

Structure parameters

• Formula: C26 H38 Br2 P2 Pt
• Calculated formula: C26 H38 Br2 P2 Pt
• SMILES: c1(c2ccccc2c(c2c1cccc2)Br)[Pt]([P](CC)(CC)CC)(Br)[P](CC)(CC)CC
• Title of publication: Remarkable Bromination and Blue Emission of 9-Anthracenyl Pt(II) Complexes
• Authors of publication: Bao-Yu Wang; Alice Raphael Karikachery; Yunjing Li; Anupam Singh; Han Baek Lee; Wenfang Sun; Paul R. Sharp
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 3150 - 3151
• a: 19.3975 ± 0.0016 Å
• b: 12.6089 ± 0.001 Å
• c: 14.2731 ± 0.0012 Å
• α: 90°
• β: 129.005 ± 0.001°
• γ: 90°
• Cell volume: 2712.8 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0212
• Residual factor for significantly intense reflections: 0.0185
• Weighted residual factors for significantly intense reflections: 0.0473
• Weighted residual factors for all reflections included in the refinement: 0.0485
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No