Information card for entry 4340244

Structure parameters

• Formula: C21.5 H27 Cu K N2 O6.5
• Calculated formula: C21.5 H27 Cu K N2 O6.5
• Title of publication: Synthesis, structures, and magnetic properties of tetranuclear CuII-LnIII complexes.
• Authors of publication: Costes, Jean-Pierre; Auchel, Magali; Dahan, Françoise; Peyrou, Viviane; Shova, Sergiu; Wernsdorfer, Wolfgang
• Journal of publication: Inorganic chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 5
• Pages of publication: 1924 - 1934
• a: 27.528 ± 0.002 Å
• b: 7.0944 ± 0.0007 Å
• c: 22.914 ± 0.0018 Å
• α: 90°
• β: 92.13 ± 0.006°
• γ: 90°
• Cell volume: 4471.9 ± 0.7 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 6
• 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: 0.0491
• Residual factor for significantly intense reflections: 0.0363
• Weighted residual factors for significantly intense reflections: 0.079
• Weighted residual factors for all reflections included in the refinement: 0.0831
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.7093 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No