Information card for entry 4076622

Structure parameters

• Formula: C22 H16 O8 Ru2
• Calculated formula: C22 H16 O8 Ru2
• Title of publication: Carbon Chain Formation on Metallic Arrays. X-ray Structural Determinations of [Ru4(μ4-(CCC(CO2Me)C(CO2Me))(η-C5H4R)2(μ-CO)(CO)8], [{Ru(CO)2(η-C5H5)}2{μ-CCC(CO2Me)C(CO2Me)C(O)}], and [{Ru(CO)2(η-C5H5)2{μ-CC(CN)2CC(CN)2}] (R = H, Me)
• Authors of publication: Byrne, Lindsay T.; Hos, James P.; Koutsantonis, George A.; Sanford, Vanessa; Skelton, Brian W.; White, Allan H.
• Journal of publication: Organometallics
• Year of publication: 2002
• Journal volume: 21
• Journal issue: 15
• Pages of publication: 3147
• a: 12.27 ± 0.0014 Å
• b: 10.107 ± 0.0011 Å
• c: 17.521 ± 0.0019 Å
• α: 90°
• β: 95.624 ± 0.002°
• γ: 90°
• Cell volume: 2162.4 ± 0.4 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 4
• 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: 0.052
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for all reflections: 0.042
• Weighted residual factors for all reflections included in the refinement: 0.039
• Goodness-of-fit parameter for all reflections: 1.215
• Goodness-of-fit parameter for all reflections included in the refinement: 1.344
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No