Information card for entry 7059023

Structure parameters

• Formula: C22 H11 N O9 Ru3
• Calculated formula: C22 H11 N O9 Ru3
• Title of publication: Activation reactions of 2-pyridyl and 2-pyrimidinyl alkynes with Ru3(CO)12
• Authors of publication: Li, Shasha; Xu, Lei; Jiang, Liping; Zhang, Guofang; Zhang, Wei-Qiang; Gao, Ziwei
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• a: 17.721 ± 0.005 Å
• b: 8.302 ± 0.002 Å
• c: 16.368 ± 0.004 Å
• α: 90°
• β: 104.13 ± 0.009°
• γ: 90°
• Cell volume: 2335.2 ± 1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• 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: 0.0959
• Residual factor for significantly intense reflections: 0.095
• Weighted residual factors for significantly intense reflections: 0.2417
• Weighted residual factors for all reflections included in the refinement: 0.2421
• Goodness-of-fit parameter for all reflections included in the refinement: 1.401
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No