Information card for entry 4316396

Structure parameters

• Formula: C29 H42 F2 N4 Pt
• Calculated formula: C29 H42 F2 N4 Pt
• SMILES: [N+](CCCC)(CCCC)(CCCC)CCCC.[Pt]1(c2cc(F)cc(F)c2c2[n]1cccc2)(C#N)C#N
• Title of publication: Bright Sky-Blue Phosphorescence of [n-Bu4N][Pt(4,6-dFppy)(CN)2]: Synthesis, Crystal Structure, and Detailed Photophysical Studies
• Authors of publication: Andreas F. Rausch; Uwe V. Monkowius; Manfred Zabel; Hartmut Yersin
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 7818 - 7825
• a: 19.6771 ± 0.0017 Å
• b: 8.1679 ± 0.0005 Å
• c: 18.4252 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2961.3 ± 0.4 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 ± 1 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0192
• Residual factor for significantly intense reflections: 0.0164
• Weighted residual factors for significantly intense reflections: 0.0386
• Weighted residual factors for all reflections included in the refinement: 0.0392
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No