Information card for entry 4324656

Structure parameters

• Common name: [Cu4(C5H5CO2)4(CN-py-NO)2(OH)2]3(CH3CN)
• Formula: C128 H93 Cu12 N19 O36
• Calculated formula: C128 H93 Cu12 N19 O36
• 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: 13.546 ± 0.002 Å
• b: 15.635 ± 0.002 Å
• c: 16.036 ± 0.003 Å
• α: 80 ± 0.03°
• β: 78.65 ± 0.03°
• γ: 77.25 ± 0.02°
• Cell volume: 3217.5 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.1254
• Residual factor for significantly intense reflections: 0.0748
• Weighted residual factors for all reflections: 0.2002
• Weighted residual factors for all reflections included in the refinement: 0.1781
• Goodness-of-fit parameter for all reflections: 1.114
• Goodness-of-fit parameter for all reflections included in the refinement: 1.282
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No