Information card for entry 4105398

Structure parameters

• Formula: C21.42 H36.51 Br0.65 Cl2.44 Mg O4 Zn
• Calculated formula: C21.364 H36.47 Br0.664 Cl2.442 Mg O4 Zn
• Title of publication: Revelation of the Difference between Arylzinc Reagents Prepared from Aryl Grignard and Aryllithium Reagents Respectively: Kinetic and Structural Features
• Authors of publication: Liqun Jin; Chao Liu; Jing Liu; Fang Hu; Yu Lan; Andrei S. Batsanov; Judith A. K. Howard; Todd B. Marder; Aiwen Lei
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 16656 - 16657
• a: 14.863 ± 0.002 Å
• b: 10.4843 ± 0.0017 Å
• c: 16.936 ± 0.003 Å
• α: 90°
• β: 100.13 ± 0.03°
• γ: 90°
• Cell volume: 2598 ± 0.8 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1915
• Residual factor for significantly intense reflections: 0.0754
• Weighted residual factors for significantly intense reflections: 0.1502
• Weighted residual factors for all reflections included in the refinement: 0.1921
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No