Information card for entry 7015846

Structure parameters

• Formula: C78 H105 La2 Mn6 N6 O27
• Calculated formula: C78 H105 La2 Mn6 N6 O27
• Title of publication: Enhancing U(eff) in oxime-bridged [Mn(III)6Ln(III)2] hexagonal prisms.
• Authors of publication: Rigaux, Guillaume; Inglis, Ross; Morrison, Susan; Prescimone, Alessandro; Cadiou, Cyril; Evangelisti, Marco; Brechin, Euan K.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 18
• Pages of publication: 4797 - 4799
• a: 15.3154 ± 0.0006 Å
• b: 22.8884 ± 0.0006 Å
• c: 25.7786 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9036.6 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 20
• Hermann-Mauguin space group symbol: C 2 2 21
• Hall space group symbol: C 2c 2
• Residual factor for all reflections: 0.0241
• Residual factor for significantly intense reflections: 0.0223
• Weighted residual factors for significantly intense reflections: 0.0567
• Weighted residual factors for all reflections included in the refinement: 0.0578
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No