Information card for entry 7107175

Structure parameters

• Formula: C44 H44 F12 N7 P3 Ru
• Calculated formula: C44 H44 F12 N7 P3 Ru
• Title of publication: Can a functionalized phosphine ligand promote room temperature luminescence of the [Ru(bpy)(tpy)]2+ core ?
• Authors of publication: Emilie Lebon; Stephanie Bastin; Pierre Sutra; Laure Vendier; Remi E. Piau; Isabelle M. Dixon; Martial Boggio-Pasqua; Fabienne Alary; Jean-Louis Heully; Alain Igau; Alberto Juris
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 741
• a: 17.2051 ± 0.0017 Å
• b: 14.2527 ± 0.0008 Å
• c: 23.982 ± 0.002 Å
• α: 90°
• β: 99.011 ± 0.012°
• γ: 90°
• Cell volume: 5808.3 ± 0.8 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 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: 0.1161
• Residual factor for significantly intense reflections: 0.0567
• Weighted residual factors for significantly intense reflections: 0.1314
• Weighted residual factors for all reflections included in the refinement: 0.1506
• Goodness-of-fit parameter for all reflections included in the refinement: 0.817
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No