Information card for entry 4324658

Structure parameters

• Common name: [Cu4(O)(C7H4N3O)4(CH3COO)2].1/4H2O
• Formula: C32 H22.5 Cu4 N12 O9.25
• Calculated formula: C32 H22.5 Cu4 N12 O9.25
• 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: 15.875 ± 0.003 Å
• b: 25.921 ± 0.005 Å
• c: 17.456 ± 0.004 Å
• α: 90°
• β: 94.71 ± 0.03°
• γ: 90°
• Cell volume: 7159 ± 3 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: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.0608
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for all reflections: 0.1231
• Weighted residual factors for all reflections included in the refinement: 0.1185
• Goodness-of-fit parameter for all reflections: 1.158
• Goodness-of-fit parameter for all reflections included in the refinement: 1.205
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No