Information card for entry 4332463

Structure parameters

• Formula: C37 H49 B2 Mn2 N7 O10
• Calculated formula: C37 H43 B2 Mn2 N7 O10
• Title of publication: Deliberate Synthesis for Magnetostructural Study of Linear Tetranuclear Complexes BIIIMnIIMnIIBIII, MnIIIMnIIMnIIMnIII, MnIVMnIIMnIIMnIV, FeIIIMnIIMnIIFeIII, and CrIIIMnIIMnIICrIII. Influence of Terminal Ions on the Exchange Coupling
• Authors of publication: Khanra, Sumit; Weyhermüller, Thomas; Bill, Eckhard; Chaudhuri, Phalguni
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 15
• Pages of publication: 5911 - 5923
• a: 11.2698 ± 0.0003 Å
• b: 11.2698 ± 0.0003 Å
• c: 27.7328 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 3050.4 ± 0.14 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 152
• Hermann-Mauguin space group symbol: P 31 2 1
• Hall space group symbol: P 31 2"
• Residual factor for all reflections: 0.042
• Residual factor for significantly intense reflections: 0.0379
• Weighted residual factors for all reflections: 0.113
• Weighted residual factors for significantly intense reflections: 0.098
• Goodness-of-fit parameter for all reflections: 1.107
• Goodness-of-fit parameter for significantly intense reflections: 1.116
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No