Information card for entry 4114139

Structure parameters

• Common name: beta-et-1
• Formula: C2 H4 Al Cl4 Cu
• Calculated formula: C2 H4 Al Cl4 Cu
• Title of publication: Sorptive Reconstruction of the CuAlCl4 Framework upon Reversible Ethylene Binding
• Authors of publication: Roger M. Sullivan; Haiming Liu; D. Steve Smith; Jonathan C. Hanson; Derek Osterhout; Michael Ciraolo; Clare P. Grey; James D. Martin
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2003
• Journal volume: 125
• Pages of publication: 11065 - 11079
• a: 7.306 ± 0.0015 Å
• b: 16.133 ± 0.003 Å
• c: 7.094 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 836.2 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0376
• Residual factor for significantly intense reflections: 0.0375
• Weighted residual factors for all reflections: 0.1421
• Weighted residual factors for significantly intense reflections: 0.1414
• Goodness-of-fit parameter for all reflections: 1.486
• Goodness-of-fit parameter for significantly intense reflections: 1.482
• Diffraction radiation wavelength: 0.9376 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No