Information card for entry 4122209

Structure parameters

• Formula: C24 H33 Cl3 F6 P Ru
• Calculated formula: C24 H33 Cl3 F6 P Ru
• Title of publication: An eta(6)-dienyne transition-metal complex.
• Authors of publication: O'connor, Joseph M.; Friese, Seth J.; Rodgers, Betsy L.; Rheingold, Arnold L.; Zakharov, Lev
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• Journal volume: 127
• Journal issue: 26
• Pages of publication: 9346 - 9347
• a: 8.9781 ± 0.0015 Å
• b: 19.432 ± 0.003 Å
• c: 16.339 ± 0.003 Å
• α: 90°
• β: 103.873 ± 0.003°
• γ: 90°
• Cell volume: 2767.4 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0459
• Residual factor for significantly intense reflections: 0.0434
• Weighted residual factors for significantly intense reflections: 0.1065
• Weighted residual factors for all reflections included in the refinement: 0.1082
• Goodness-of-fit parameter for all reflections included in the refinement: 1.111
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No