Information card for entry 7048640

Structure parameters

• Formula: C52 H71 Au2 Cl2 F N2 P2
• Calculated formula: C52 H71 Au2 Cl2 F N2 P2
• Title of publication: Metastable phosphorus neutral monoradical: a key intermediate in the bicyclic cage formation.
• Authors of publication: Chen, Xiaodan; Hinz, Alexander; Harmer, Jeffrey R.; Li, Zhongshu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 8
• Pages of publication: 2549 - 2553
• a: 30.0735 ± 0.0015 Å
• b: 10.7348 ± 0.0003 Å
• c: 23.2145 ± 0.0012 Å
• α: 90°
• β: 130.949 ± 0.009°
• γ: 90°
• Cell volume: 5660.5 ± 0.9 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0592
• Residual factor for significantly intense reflections: 0.0546
• Weighted residual factors for significantly intense reflections: 0.1378
• Weighted residual factors for all reflections included in the refinement: 0.1445
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No