Information card for entry 7040563

Structure parameters

• Formula: C177 H129 Mn8 N15 O37
• Calculated formula: C177 H117 Mn8 N15 O37
• 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: 31.8857 ± 0.0004 Å
• b: 31.8857 ± 0.0004 Å
• c: 31.8857 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 32418.1 ± 0.7 ų
• Cell temperature: 185 ± 2 K
• Ambient diffraction temperature: 185 ± 2 K
• Number of distinct elements: 5
• Space group number: 205
• Hermann-Mauguin space group symbol: P a -3
• Hall space group symbol: -P 2ac 2ab 3
• Residual factor for all reflections: 0.1492
• Residual factor for significantly intense reflections: 0.0997
• Weighted residual factors for significantly intense reflections: 0.25
• Weighted residual factors for all reflections included in the refinement: 0.2995
• Goodness-of-fit parameter for all reflections included in the refinement: 1.153
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No