Information card for entry 7127626

Structure parameters

• Formula: C35 H47 Cl N2 O Pt
• Calculated formula: C35 H47 Cl N2 O Pt
• SMILES: [Pt]12([n]3c(c4[n]1c(cc(c4)C(C)(C)C)CO[C@@H]1[C@H](CC[C@@H](C1)C)C(C)C)cc(cc3c1ccccc21)C(C)(C)C)Cl
• Title of publication: Access to functionalized luminescent Pt(ii) complexes by photoredox-catalyzed Minisci alkylation of 6-aryl-2,2'-bipyridines.
• Authors of publication: Hagui, Wided; Cordier, Marie; Boixel, Julien; Soulé, Jean-François
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 8
• Pages of publication: 1038 - 1041
• a: 8.8293 ± 0.0007 Å
• b: 31.745 ± 0.003 Å
• c: 12.7745 ± 0.0009 Å
• α: 90°
• β: 95.744 ± 0.003°
• γ: 90°
• Cell volume: 3562.5 ± 0.5 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.088
• Residual factor for significantly intense reflections: 0.0783
• Weighted residual factors for significantly intense reflections: 0.1933
• Weighted residual factors for all reflections included in the refinement: 0.1999
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No