Information card for entry 7049304

Structure parameters

• Formula: C89 H66 F48 Mn4 N12 O20
• Calculated formula: C89 H66 F48 Mn4 N12 O20
• Title of publication: Syntheses and magnetic properties of a bis-tridentate nitronyl nitroxide radical and its metal complexes.
• Authors of publication: Miao, Hao; Li, Miao; Li, Hong-Qing; Shen, Fu-Xing; Zhang, Yi-Quan; Wang, Xin-Yi
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 15
• Pages of publication: 4774 - 4778
• a: 17.143 ± 0.002 Å
• b: 16.374 ± 0.002 Å
• c: 21.215 ± 0.003 Å
• α: 90°
• β: 113.3 ± 0.003°
• γ: 90°
• Cell volume: 5469.4 ± 1.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0752
• Residual factor for significantly intense reflections: 0.0658
• Weighted residual factors for significantly intense reflections: 0.1785
• Weighted residual factors for all reflections included in the refinement: 0.1859
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No