Information card for entry 7129846

Structure parameters

• Formula: C41 H36 F5 I N2 O4 Pt S
• Calculated formula: C41 H36 F5 I N2 O4 Pt S
• Title of publication: Phosphorescent biaryl platinum(IV) complexes obtained through double metalation of dibenzoiodolium ions.
• Authors of publication: López-López, Juan-Carlos; Bautista, Delia; González-Herrero, Pablo
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2022
• Journal volume: 58
• Journal issue: 28
• Pages of publication: 4532 - 4535
• a: 16.2963 ± 0.001 Å
• b: 21.4916 ± 0.0013 Å
• c: 11.4378 ± 0.0007 Å
• α: 90°
• β: 101.459 ± 0.002°
• γ: 90°
• Cell volume: 3926.1 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0548
• Residual factor for significantly intense reflections: 0.0355
• Weighted residual factors for significantly intense reflections: 0.0735
• Weighted residual factors for all reflections included in the refinement: 0.0817
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No