Information card for entry 4077595

Structure parameters

• Formula: C38 H21 Cl0.3 N O9 Ru3
• Calculated formula: C38 H21 Cl0.3 N O9 Ru3
• Title of publication: Reactivity of Diynes with a 1-Azavinylidene-Bridged Triruthenium Carbonyl Cluster. Insertion Reactions of Diynes into Ru−H, Ru−C, and Ru−N Bonds
• Authors of publication: Cabeza, Javier A.; Grepioni, Fabrizia; Moreno, Marta; Riera, Víctor
• Journal of publication: Organometallics
• Year of publication: 2000
• Journal volume: 19
• Journal issue: 25
• Pages of publication: 5424
• a: 12.445 ± 0.003 Å
• b: 13.029 ± 0.004 Å
• c: 13.946 ± 0.005 Å
• α: 76.2 ± 0.03°
• β: 72.28 ± 0.02°
• γ: 87.23 ± 0.02°
• Cell volume: 2091.1 ± 1.2 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1181
• Residual factor for significantly intense reflections: 0.0538
• Weighted residual factors for significantly intense reflections: 0.1376
• Weighted residual factors for all reflections included in the refinement: 0.1672
• Goodness-of-fit parameter for all reflections included in the refinement: 0.921
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No