Information card for entry 7034152

Structure parameters

• Formula: C60 H76 Mn6 N8 O26 S4
• Calculated formula: C60 H76 Mn6 N8 O26 S4
• Title of publication: Solvent dependent reactivities of di-, tetra- and hexanuclear manganese complexes: syntheses, structures and magnetic properties.
• Authors of publication: Yang, Hua; Cao, Fan; Li, Dacheng; Zeng, Suyuan; Song, You; Dou, Jianmin
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 14
• Pages of publication: 6620 - 6629
• a: 11.273 ± 0.0011 Å
• b: 12.4619 ± 0.0012 Å
• c: 13.9091 ± 0.0014 Å
• α: 108.769 ± 0.002°
• β: 102.03 ± 0.001°
• γ: 91.856 ± 0.001°
• Cell volume: 1799 ± 0.3 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: 0.2154
• Residual factor for significantly intense reflections: 0.1218
• Weighted residual factors for significantly intense reflections: 0.264
• Weighted residual factors for all reflections included in the refinement: 0.3872
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No