Information card for entry 4306348

Structure parameters

• Formula: C38 H32 Cu4 N16 O8
• Calculated formula: C38 H32 Cu4 N16 O8
• Title of publication: Di-2-pyridyl Ketone/Benzoate/Azide Combination as a Source of Copper(II) Clusters and Coordination Polymers: Dependence of the Product Identity on the Solvent
• Authors of publication: Theocharis C. Stamatatos; Vassilis Tangoulis; Catherine P. Raptopoulou; Aris Terzis; Giannis S. Papaefstathiou; Spyros P. Perlepes
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 7969 - 7971
• a: 21.69 ± 0.01 Å
• b: 12.867 ± 0.009 Å
• c: 16.81 ± 0.01 Å
• α: 90°
• β: 114.46 ± 0.02°
• γ: 90°
• Cell volume: 4270 ± 4 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0446
• Residual factor for significantly intense reflections: 0.0389
• Weighted residual factors for significantly intense reflections: 0.1025
• Weighted residual factors for all reflections included in the refinement: 0.1079
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No