Information card for entry 7004009

Structure parameters

• Formula: C84 H60 F6 O14 Ru2 S2
• Calculated formula: C84 H60 F6 O14 Ru2 S2
• Title of publication: Formation of acylruthenium promoted by coordination of AlMe3 to (η4-cyclopentadienone)Ru(CO)3
• Authors of publication: Ogoshi, Sensuke; Kato, Tetsuya; Ohashi, Masato; Kurosawa, Hideo
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 17
• Pages of publication: 2232 - 2234
• a: 17.079 ± 0.006 Å
• b: 19.512 ± 0.006 Å
• c: 23.835 ± 0.008 Å
• α: 90°
• β: 107.013 ± 0.003°
• γ: 90°
• Cell volume: 7595 ± 4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 292 ± 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: 0.2073
• Residual factor for significantly intense reflections: 0.1028
• Weighted residual factors for significantly intense reflections: 0.142
• Weighted residual factors for all reflections included in the refinement: 0.176
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No