Information card for entry 7117396

Structure parameters

• Formula: C39 H41 Mn N8 O7 U
• Calculated formula: C39 H41 Mn N8 O7 U
• Title of publication: A zig-zag uranyl(V)-Mn(II) single chain magnet with a high relaxation barrier
• Authors of publication: Lucile Chatelain; Floriana Tuna; Jacques Pecaut; Marinella Mazzanti
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 11309
• a: 25.9044 ± 0.0009 Å
• b: 13.2058 ± 0.0003 Å
• c: 23.7598 ± 0.0008 Å
• α: 90°
• β: 99.772 ± 0.003°
• γ: 90°
• Cell volume: 8010 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.1141
• Residual factor for significantly intense reflections: 0.0501
• Weighted residual factors for significantly intense reflections: 0.0697
• Weighted residual factors for all reflections included in the refinement: 0.0853
• Goodness-of-fit parameter for all reflections included in the refinement: 0.967
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No