Information card for entry 7014131

Structure parameters

• Formula: C38 H38 F12 N6 O P2 Ru
• Calculated formula: C38 H37 F12 N6 O P2 Ru
• Title of publication: The synthesis and structure of heteroleptic tris(diimine)ruthenium(II) complexes.
• Authors of publication: Kepert, Christopher M.; Bond, Alan M.; Deacon, Glen B.; Spiccia, Leone; Skelton, Brian W.; White, Allan H.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2004
• Journal issue: 11
• Pages of publication: 1766 - 1774
• a: 12.1746 ± 0.0003 Å
• b: 11.8272 ± 0.0003 Å
• c: 28.4782 ± 0.0008 Å
• α: 90°
• β: 100.655 ± 0.001°
• γ: 90°
• Cell volume: 4029.92 ± 0.18 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.189
• Residual factor for significantly intense reflections: 0.056
• Weighted residual factors for all reflections: 0.094
• Weighted residual factors for all reflections included in the refinement: 0.064
• Goodness-of-fit parameter for all reflections: 1.095
• Goodness-of-fit parameter for all reflections included in the refinement: 1.205
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No