Information card for entry 4072850

Structure parameters

• Formula: C46 H46 Cl6 P2 Pt Ru
• Calculated formula: C46 H46 Cl6 P2 Pt Ru
• SMILES: [Pt]1(Cl)(Cl)[P]23[Ru]456789%10([C]2(=[C]4([C]5(=[C]36c2c([P]1(c1ccccc1)c1ccccc1)ccc1ccccc21)C)C)c1ccccc1)[c]1([c]7([c]8([c]9([c]%101C)C)C)C)C.ClCCl.ClCCl
• Title of publication: Planar-to-Axial Chirality Relay in Phospharuthenocenes. A Rotationally Hindered 2-(2‘-Diphenylphosphinonaphth-1‘-yl)phospharuthenocene
• Authors of publication: Carmichael, Duncan; Ricard, Louis; Seeboth, Nicolas
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 12
• Pages of publication: 2964
• a: 11.315 ± 0.001 Å
• b: 20.571 ± 0.001 Å
• c: 19.376 ± 0.001 Å
• α: 90°
• β: 98.406 ± 0.001°
• γ: 90°
• Cell volume: 4461.5 ± 0.5 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 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: 0.0662
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for significantly intense reflections: 0.0991
• Weighted residual factors for all reflections included in the refinement: 0.1075
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No