Information card for entry 7044350

Structure parameters

• Formula: C21 H21 Co Dy N9 O12
• Calculated formula: C21 H21 Co Dy N9 O12
• SMILES: [Dy]12345(O[N]6=C(c7cccc[n]7[Co]786([n]6ccccc6C(C)=[N]7O1)[n]1ccccc1C(C)=[N]8O2)C)([O]=N(=O)O3)([O]=N(=O)O4)[O]=N(=O)O5
• Title of publication: “Switching on” the single-molecule magnet properties within a series of dinuclear cobalt(III)-dysprosium(III) 2-pyridyloximate complexes
• Authors of publication: Perlepes, Spyros P.; Polyzou, Christina D.; Koumousi, Evangelia S.; Lada, Zoi G.; Raptopoulou, Catherine P.; Psycharis, Vassilis; Rouzieres, Mathieu; Tsipis, Athanassios C.; Mathoniere, Corine; Clerac, Rodolphe
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 15.0503 ± 0.0002 Å
• b: 15.0503 ± 0.0002 Å
• c: 10.2997 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 2020.44 ± 0.04 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 ± 2 K
• Number of distinct elements: 6
• Space group number: 146
• Hermann-Mauguin space group symbol: R 3 :H
• Hall space group symbol: R 3
• Residual factor for all reflections: 0.0374
• Residual factor for significantly intense reflections: 0.0368
• Weighted residual factors for significantly intense reflections: 0.0713
• Weighted residual factors for all reflections included in the refinement: 0.0715
• Goodness-of-fit parameter for all reflections included in the refinement: 0.983
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No