Information card for entry 7040561

Structure parameters

• Formula: C225 H168 Cl4 Mn12 N40 O51
• Calculated formula: C225 H168 Cl4 Mn12 N40 O51
• Title of publication: Manganese clusters of aromatic oximes: synthesis, structure and magnetic properties.
• Authors of publication: Chen, Zilu; Hu, Zhaobo; Li, Yisheng; Liang, Yuning; Wang, Xinyu; Ouyang, Li; Zhao, Qin; Cheng, Haiyan; Liang, Fupei
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 39
• Pages of publication: 15634 - 15643
• a: 17.1115 ± 0.0008 Å
• b: 18.8978 ± 0.0006 Å
• c: 19.9978 ± 0.0006 Å
• α: 67.248 ± 0.003°
• β: 89.768 ± 0.003°
• γ: 70.924 ± 0.004°
• Cell volume: 5580.2 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0959
• Residual factor for significantly intense reflections: 0.0603
• Weighted residual factors for significantly intense reflections: 0.1642
• Weighted residual factors for all reflections included in the refinement: 0.1951
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No