Information card for entry 7061851

Structure parameters

• Common name: complex1
• Formula: C72 H62 Cl2 Mn4 N8 O20 S2 Se2
• Calculated formula: C72 H62 Cl2 Mn4 N8 O20 S2 Se2
• Title of publication: A single chain magnet based on a 1D polymeric selenite-bridged Mn(iii) complex with an N2O2 donor
• Authors of publication: Zhang, Shao-Liang; Yue, Cai-Ran; Dong, Yi-Nuo; Liu, Xiao-Na; Wang, Yan-Lan; Li, Shan-Shan
• Journal of publication: New Journal of Chemistry
• Year of publication: 2022
• Journal volume: 46
• Journal issue: 39
• Pages of publication: 19018 - 19023
• a: 10.1306 ± 0.0009 Å
• b: 13.3142 ± 0.0012 Å
• c: 14.1644 ± 0.0014 Å
• α: 98.053 ± 0.002°
• β: 109.008 ± 0.003°
• γ: 101.939 ± 0.002°
• Cell volume: 1722.2 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.212
• Residual factor for significantly intense reflections: 0.1104
• Weighted residual factors for significantly intense reflections: 0.2442
• Weighted residual factors for all reflections included in the refinement: 0.2756
• Goodness-of-fit parameter for all reflections included in the refinement: 0.992
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No