Information card for entry 2021985

Structure parameters

• Chemical name: Penta-μ-acetato-bis(μ~2~-2-{[2-(6-chloropyridin-2-yl)hydrazinylidene]\ methyl}-6-methoxyphenolato)-μ-formato-tetramanganese(II)
• Formula: C37.17 H38.34 Cl2 Mn4 N6 O16
• Calculated formula: C37.168 H38.336 Cl2 Mn4 N6 O16
• Title of publication: Synthesis, crystal structures and magnetic and electrochemiluminescence properties of three manganese(II) complexes
• Authors of publication: Chen, Yating; Zhang, Shaonan; Xiao, Yu; Zhang, Shuhua
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2020
• Journal volume: 76
• Journal issue: 3
• a: 8.5495 ± 0.0007 Å
• b: 11.055 ± 0.0007 Å
• c: 12.5947 ± 0.0007 Å
• α: 76.143 ± 0.005°
• β: 73.11 ± 0.006°
• γ: 81.533 ± 0.006°
• Cell volume: 1102.02 ± 0.14 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1016
• Residual factor for significantly intense reflections: 0.0536
• Weighted residual factors for significantly intense reflections: 0.1078
• Weighted residual factors for all reflections included in the refinement: 0.1356
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes