Information card for entry 1545893

Structure parameters

• Formula: C4 H12 Cu2 I2 N2
• Calculated formula: C4 H12 Cu2 I2 N2
• Title of publication: Copper-catalysed aromatic-Finkelstein reactions with amine-based ligand systems
• Authors of publication: Jin, Xiaodong; Davies, Robert P.
• Journal of publication: Catal. Sci. Technol.
• Year of publication: 2017
• a: 11.7663 ± 0.0003 Å
• b: 11.7663 ± 0.0003 Å
• c: 7.5184 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1040.89 ± 0.06 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 86
• Hermann-Mauguin space group symbol: P 42/n
• Hall space group symbol: -P 4bc
• Residual factor for all reflections: 0.0333
• Residual factor for significantly intense reflections: 0.0263
• Weighted residual factors for significantly intense reflections: 0.0452
• Weighted residual factors for all reflections included in the refinement: 0.0469
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No