Information card for entry 7013807

Structure parameters

• Formula: C45 H39 I O2 P2 Ru
• Calculated formula: C45 H39 I O2 P2 Ru
• Title of publication: Stereoselective ligand-exchange reaction of planar-chiral cyclopentadienyl-ruthenium complexes: thermodynamic control of configuration at a stereogenic metal center.
• Authors of publication: Matsushima, Yuji; Onitsuka, Kiyotaka; Takahashi, Shigetoshi
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2004
• Journal issue: 4
• Pages of publication: 547 - 553
• a: 12.481 ± 0.002 Å
• b: 14.921 ± 0.002 Å
• c: 20.483 ± 0.001 Å
• α: 90°
• β: 100.05 ± 0.008°
• γ: 90°
• Cell volume: 3756 ± 0.8 ų
• Cell temperature: 223.2 K
• Ambient diffraction temperature: 223.2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0305
• Weighted residual factors for significantly intense reflections: 0.0373
• Weighted residual factors for all reflections included in the refinement: 0.0373
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No