Information card for entry 7127624

Structure parameters

• Formula: C30 H37 Cl N2 O2 Pt
• Calculated formula: C30 H37 Cl N2 O2 Pt
• SMILES: [Pt]12([n]3c(c4[n]1c(cc(c4)C(C)(C)C)CCCCC(=O)OC)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: 9.7019 ± 0.0007 Å
• b: 19.1155 ± 0.0015 Å
• c: 14.6419 ± 0.0011 Å
• α: 90°
• β: 94.022 ± 0.002°
• γ: 90°
• Cell volume: 2708.8 ± 0.4 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• 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: 0.0405
• Residual factor for significantly intense reflections: 0.0295
• Weighted residual factors for significantly intense reflections: 0.0682
• Weighted residual factors for all reflections included in the refinement: 0.075
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No