Information card for entry 7705869

Structure parameters

• Formula: C60 H46 Cl4 Mn2 N4 O8.7
• Calculated formula: C60 H46 Cl4 Mn2 N4 O8.7
• Title of publication: Canting angle dependence of single-chain magnet behaviour in chirality-introduced antiferromagnetic chains of acetate-bridged manganese(III) salen-type complexes.
• Authors of publication: Huang, Po-Jung; Miyasaka, Hitoshi
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 46
• Pages of publication: 16970 - 16978
• a: 6.5703 ± 0.0002 Å
• b: 17.9817 ± 0.0004 Å
• c: 45.3393 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5356.6 ± 0.3 ų
• Cell temperature: 103 K
• Ambient diffraction temperature: 103 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1266
• Residual factor for significantly intense reflections: 0.0696
• Weighted residual factors for significantly intense reflections: 0.1095
• Weighted residual factors for all reflections included in the refinement: 0.1271
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No