Information card for entry 1544326

Structure parameters

• Chemical name: [Os(bpy)2(dppcb)Pd(dppm)](PF6)4
• Formula: C99.54 H82 Cl5.08 F24 N4 Os P10 Pd
• Calculated formula: C99.54 H82 Cl5.08 F24 N4 Os P10 Pd
• SMILES: [Os]123([P]([C@@H]4[C@H]([P]1(c1ccccc1)c1ccccc1)[C@H]1[P]([Pd]5([P]([C@@H]41)(c1ccccc1)c1ccccc1)[P](C[P]5(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)([n]1ccccc1c1[n]2cccc1)[n]1ccccc1c1[n]3cccc1.ClCCl.ClCCl.ClCCl.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Stabilisation effects of phosphane ligands in the homogeneous approach of sunlight induced hydrogen production
• Authors of publication: Brueggeller, Peter; Strabler, Christof; Sinn, Stephan; Pehn, Richard; Pann, Johann; Dutzler, Julian; Viertl, Wolfgang; Prock, Johannes; Ehrmann, Katharina; Weninger, Alexander; Kopacka, Holger; De Cola, Luisa
• Journal of publication: Faraday Discuss.
• Year of publication: 2016
• a: 17.6742 ± 0.0003 Å
• b: 13.931 ± 0.0002 Å
• c: 24.3295 ± 0.0004 Å
• α: 90°
• β: 107.34 ± 0.0008°
• γ: 90°
• Cell volume: 5718.15 ± 0.16 ų
• Cell temperature: 243 ± 2 K
• Ambient diffraction temperature: 243 ± 2 K
• Number of distinct elements: 8
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 n 1
• Hall space group symbol: P -2yac
• Residual factor for all reflections: 0.089
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for significantly intense reflections: 0.1184
• Weighted residual factors for all reflections included in the refinement: 0.1295
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No