Information card for entry 4327979

Structure parameters

• Formula: C12 H31 Cl2 Cu3 N15 O18
• Calculated formula: C12 H31 Cl2 Cu3 N15 O18
• Title of publication: Antisymmetric Exchange in Triangular Tricopper(II) Complexes: Correlation among Structural, Magnetic, and Electron Paramagnetic Resonance Parameters
• Authors of publication: Sacramento Ferrer; Francesc Lloret; Emilio Pardo; Juan Modesto Clemente-Juan; Malva Liu-González; Santiago García-Granda
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 985 - 1001
• a: 11.216 ± 0.002 Å
• b: 11.538 ± 0.002 Å
• c: 13.696 ± 0.003 Å
• α: 76.68 ± 0.011°
• β: 69.074 ± 0.011°
• γ: 88.28 ± 0.011°
• Cell volume: 1608.3 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1331
• Residual factor for significantly intense reflections: 0.0882
• Weighted residual factors for significantly intense reflections: 0.229
• Weighted residual factors for all reflections included in the refinement: 0.2706
• Goodness-of-fit parameter for all reflections included in the refinement: 0.966
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No