Information card for entry 4324655

Structure parameters

• Common name: [Cu4(O)(C7H4N3O)4(CH3COO)2].1/4H2O)
• Formula: C128 H90 Cu16 N48 O37
• Calculated formula: C128 H90 Cu16 N48 O37
• Title of publication: Trinuclear, Tetranuclear, and Polymeric CuII Complexes from the First Use of 2-Pyridylcyanoxime in Transition Metal Chemistry: Synthetic, Structural, and Magnetic Studies
• Authors of publication: Albert Escuer; Gina Vlahopoulou; Spyros P. Perlepes; Franz A. Mautner
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 2468 - 2478
• a: 22.611 ± 0.005 Å
• b: 25.921 ± 0.005 Å
• c: 15.875 ± 0.003 Å
• α: 90°
• β: 129.7 ± 0.03°
• γ: 90°
• Cell volume: 7159 ± 4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0608
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for all reflections: 0.1237
• Weighted residual factors for all reflections included in the refinement: 0.119
• Goodness-of-fit parameter for all reflections: 1.147
• Goodness-of-fit parameter for all reflections included in the refinement: 1.193
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No