Information card for entry 4341686

Structure parameters

• Formula: C68 H118 Cl5 Cu2 Dy7 N4 O45
• Calculated formula: C68 H86 Cl5 Cu2 Dy7 N4 O45
• Title of publication: Synthesis, Structure, and Magnetism of a Family of Heterometallic {Cu2Ln7} and {Cu4Ln12} (Ln = Gd, Tb, and Dy) Complexes: The Gd Analogues Exhibiting a Large Magnetocaloric Effect
• Authors of publication: Langley, Stuart K.; Moubaraki, Boujemaa; Tomasi, Corrado; Evangelisti, Marco; Brechin, Euan K.; Murray, Keith S.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2014
• Pages of publication: 141119100121008
• a: 31.89 ± 0.006 Å
• b: 11.82 ± 0.002 Å
• c: 29.22 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 11014 ± 4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0351
• Residual factor for significantly intense reflections: 0.0337
• Weighted residual factors for significantly intense reflections: 0.0931
• Weighted residual factors for all reflections included in the refinement: 0.0939
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71078 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No