Information card for entry 7026245

Structure parameters

• Formula: C68 H57 Br8 Mn5 N4 O21.5
• Calculated formula: C68 H54 Br8 Mn5 N4 O21.5
• Title of publication: Syntheses, crystal structures and magnetic properties of a novel family of penta-manganese complexes derived from an assembly system containing polydentate hydroxy-rich Schiff-base ligands.
• Authors of publication: Yang, Pei-Pei; Song, Xue-Yan; Liu, Rui-Na; Li, Li-Cun; Liao, Dai-Zheng
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 27
• Pages of publication: 6285 - 6294
• a: 15.291 ± 0.003 Å
• b: 28.574 ± 0.006 Å
• c: 21.534 ± 0.004 Å
• α: 90°
• β: 109.97 ± 0.03°
• γ: 90°
• Cell volume: 8843 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.2308
• Residual factor for significantly intense reflections: 0.1177
• Weighted residual factors for significantly intense reflections: 0.2774
• Weighted residual factors for all reflections included in the refinement: 0.3397
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No