Information card for entry 4125696

Structure parameters

• Formula: C67 H73 Cl4 N3 O3 Os P2
• Calculated formula: C67 H67 Cl4 N3 O3 Os P2
• Title of publication: Reactions of Isocyanides with Metal Carbyne Complexes: Isolation and Characterization of Metallacyclopropenimine Intermediates.
• Authors of publication: Luo, Ming; Long, Lipeng; Zhang, Hong; Yang, Yuhui; Hua, Yuhui; Liu, Gang; Lin, Zhenyang; Xia, Haiping
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2017
• Journal volume: 139
• Journal issue: 5
• Pages of publication: 1822 - 1825
• a: 11.6666 ± 0.0004 Å
• b: 12.6271 ± 0.0004 Å
• c: 22.2623 ± 0.0006 Å
• α: 93.498 ± 0.002°
• β: 98.272 ± 0.002°
• γ: 108.058 ± 0.003°
• Cell volume: 3066.1 ± 0.18 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.047
• Residual factor for significantly intense reflections: 0.0392
• Weighted residual factors for significantly intense reflections: 0.0906
• Weighted residual factors for all reflections included in the refinement: 0.0936
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No