Information card for entry 7118093

Structure parameters

• Formula: C20 H42 Cl2 N2 Zn
• Calculated formula: C20 H42 Cl2 N2 Zn
• Title of publication: Asymmetric bromine-lithium exchange: on the importance of both the diamine ligand and the organolithium reagent
• Authors of publication: Jezabel Praz; Julien Graff; Leo Egger; Laure Guenee; Simon Wagschal; E. Peter Kundig; Alexandre Alexakis
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 16912
• a: 7.7915 ± 0.0004 Å
• b: 14.3961 ± 0.0008 Å
• c: 23.6463 ± 0.0019 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2652.3 ± 0.3 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0507
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.1356
• Weighted residual factors for all reflections included in the refinement: 0.1382
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No