Information card for entry 4335683

Structure parameters

• Formula: C74 H140 Gd2 Mn2 O20
• Calculated formula: C74 H140 Gd2 Mn2 O20
• Title of publication: New Synthetic Route toward Heterometallic 3d-3d' and 3d-4f Single-Molecule Magnets. The First CoII-MnIII Heterometallic Complex
• Authors of publication: Guilherme P. Guedes; Stéphane Soriano; Luiza A. Mercante; Nivaldo L. Speziali; Miguel A. Novak; Marius Andruh; Maria G. F. Vaz
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 8309 - 8311
• a: 10.5291 ± 0.0006 Å
• b: 14.5298 ± 0.0008 Å
• c: 14.8549 ± 0.0008 Å
• α: 102.492 ± 0.005°
• β: 104.694 ± 0.005°
• γ: 95.72 ± 0.005°
• Cell volume: 2117.3 ± 0.2 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.113
• Residual factor for significantly intense reflections: 0.0724
• Weighted residual factors for significantly intense reflections: 0.1724
• Weighted residual factors for all reflections included in the refinement: 0.2078
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No