Information card for entry 4308651

Structure parameters

• Common name: (MnII3MnIII4L6).7C2H4Cl2
• Formula: C80 H106 Cl14 Mn7 N12 O30
• Calculated formula: C80 H78 Cl14 Mn7 N12 O30
• Title of publication: Antiferromagnetic FeIII6 Ring and Single-Molecule Magnet MnII3MnIII4 Wheel
• Authors of publication: Satoshi Koizumi; Masayuki Nihei; Motohiro Nakano; Hiroki Oshio
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 1208 - 1210
• a: 17.24 ± 0.004 Å
• b: 11.72 ± 0.003 Å
• c: 27.789 ± 0.007 Å
• α: 90°
• β: 101.434 ± 0.005°
• γ: 90°
• Cell volume: 5503 ± 2 ų
• Cell temperature: 203.15 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0873
• Residual factor for significantly intense reflections: 0.0679
• Weighted residual factors for significantly intense reflections: 0.1922
• Weighted residual factors for all reflections included in the refinement: 0.2088
• Goodness-of-fit parameter for all reflections included in the refinement: 0.951
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No