Information card for entry 4085569

Structure parameters

• Formula: C49.5 H91 Cl5 Os P2 Si2
• Calculated formula: C49.5 H91.04 Cl5.01 Os P2 Si2
• Title of publication: Rearrangement of Metallabenzynes to Chlorocyclopentadienyl Complexes
• Authors of publication: Chen, Jiangxi; Lee, Ka-Ho; Wen, Tingbin; Gao, Feng; Sung, Herman H. Y.; Williams, Ian D.; Lin, Zhenyang; Jia, Guochen
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 5
• Pages of publication: 890
• a: 20.145 ± 0.002 Å
• b: 18.337 ± 0.002 Å
• c: 16.97 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6268.7 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0447
• Residual factor for significantly intense reflections: 0.0298
• Weighted residual factors for significantly intense reflections: 0.0768
• Weighted residual factors for all reflections included in the refinement: 0.0809
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No