Information card for entry 4109395

Structure parameters

• Formula: C17 H14 Cu N2 O7
• Calculated formula: C17 H14 Cu N2 O7
• Title of publication: Synthesis of Organic Photodimeric Cage Molecules Based on Cycloaddition via Metal-Ligand Directed Assembly
• Authors of publication: Jarrod F. Eubank; Victor Ch. Kravtsov; Mohamed Eddaoudi
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2007
• Journal volume: 129
• Pages of publication: 5820 - 5821
• a: 8.738 ± 0.003 Å
• b: 10.188 ± 0.004 Å
• c: 10.76 ± 0.004 Å
• α: 63.08 ± 0.007°
• β: 83.713 ± 0.008°
• γ: 76.77 ± 0.007°
• Cell volume: 831.4 ± 0.5 ų
• Cell temperature: 571 ± 2 K
• Ambient diffraction temperature: 571 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0999
• Residual factor for significantly intense reflections: 0.0597
• Weighted residual factors for significantly intense reflections: 0.0913
• Weighted residual factors for all reflections included in the refinement: 0.1033
• Goodness-of-fit parameter for all reflections included in the refinement: 0.939
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No