Information card for entry 4330579

Structure parameters

• Formula: C36 H42 Cu3 Dy N9 O18
• Calculated formula: C36 H42 Cu3 Dy N9 O18
• Title of publication: Synthesis and Magnetic Properties of a New Family of Macrocyclic MII3LnIII Complexes: Insights into the Effect of Subtle Chemical Modification on Single-Molecule Magnet Behavior
• Authors of publication: Humphrey L. C. Feltham; Rodolphe Clérac; Liviu Ungur; Veacheslav Vieru; Liviu F. Chibotaru; Annie K. Powell; Sally Brooker
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 10603 - 10612
• a: 12.1722 ± 0.0014 Å
• b: 13.4004 ± 0.0014 Å
• c: 14.7438 ± 0.0014 Å
• α: 109.487 ± 0.005°
• β: 95.676 ± 0.005°
• γ: 110.021 ± 0.005°
• Cell volume: 2067.6 ± 0.4 ų
• Cell temperature: 92 ± 2 K
• Ambient diffraction temperature: 92 ± 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: 0.0561
• Residual factor for significantly intense reflections: 0.0464
• Weighted residual factors for significantly intense reflections: 0.1117
• Weighted residual factors for all reflections included in the refinement: 0.1199
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No