Information card for entry 1549567

Structure parameters

• Formula: C55 H52 Cl8 Os P2 Si
• Calculated formula: C55 H52 Cl8 Os P2 Si
• Title of publication: Facile synthesis of polycyclic metallaarynes.
• Authors of publication: Ruan, Wenqing; Leung, Tsz-Fai; Shi, Chuan; Lee, Ka Ho; Sung, Herman H. Y.; Williams, Ian D.; Lin, Zhenyang; Jia, Guochen
• Journal of publication: Chemical science
• Year of publication: 2018
• Journal volume: 9
• Journal issue: 27
• Pages of publication: 5994 - 5998
• a: 11.4227 ± 0.0002 Å
• b: 17.2735 ± 0.0003 Å
• c: 13.9125 ± 0.0003 Å
• α: 90°
• β: 102.838 ± 0.0019°
• γ: 90°
• Cell volume: 2676.46 ± 0.09 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 6
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0466
• Residual factor for significantly intense reflections: 0.0424
• Weighted residual factors for significantly intense reflections: 0.1003
• Weighted residual factors for all reflections included in the refinement: 0.1023
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No