Information card for entry 4518850

Structure parameters

• Formula: C55.5 H51 F6 Fe I N O7 P3 Pt S2
• Calculated formula: C55.5 H51 F6 Fe I N O7 P3 Pt S2
• Title of publication: Hydration of Cyanohydrins by Highly Active Cationic Pt Catalysts: Mechanism and Scope
• Authors of publication: Li, Chengcheng; Chang, Xiao-Yong; Huo, Luqiong; Tan, Haibo; Xing, Xiangyou; Xu, Chen
• Journal of publication: ACS Catalysis
• Year of publication: 2021
• Journal volume: 11
• Journal issue: 14
• Pages of publication: 8716 - 8726
• a: 12.0101 ± 0.0007 Å
• b: 13.0185 ± 0.0008 Å
• c: 20.5982 ± 0.0012 Å
• α: 89.708 ± 0.003°
• β: 73.604 ± 0.003°
• γ: 66.285 ± 0.003°
• Cell volume: 2807.1 ± 0.3 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 10
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0543
• Residual factor for significantly intense reflections: 0.0515
• Weighted residual factors for significantly intense reflections: 0.1301
• Weighted residual factors for all reflections included in the refinement: 0.1331
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No