Information card for entry 7015366

Structure parameters

• Formula: C36 H43 Cl Mn2 N4 O12
• Calculated formula: C36 H43 Cl Mn2 N4 O12
• Title of publication: Synthesis, structure, magnetic properties and DFT calculations of two hydroxo-bridged complexes based on Mn(III)(Schiff-Bases).
• Authors of publication: Zhou, Hong-Bo; Wang, Hui-Sheng; Chen, Ying; Xu, Yong-Lu; Song, Xiao-Jiao; Song, You; Zhang, Yi-Quan; You, Xiao-Zeng
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 22
• Pages of publication: 5999 - 6006
• a: 13.886 ± 0.004 Å
• b: 23.749 ± 0.006 Å
• c: 14.729 ± 0.003 Å
• α: 90°
• β: 122.03 ± 0.019°
• γ: 90°
• Cell volume: 4118 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1083
• Residual factor for significantly intense reflections: 0.0664
• Weighted residual factors for significantly intense reflections: 0.159
• Weighted residual factors for all reflections included in the refinement: 0.1717
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No