Information card for entry 4350093

Structure parameters

• Formula: C70 H60 F12 Mn N8 O6 P2
• Calculated formula: C70 H60 F12 Mn N8 O6 P2
• Title of publication: A combination of super-resolution fluorescence and magnetic resonance imaging using a Mn(ii) compound
• Authors of publication: Tian, Xiaohe; Xiao, Lufei; Shen, Yu; Luo, Lei; Zhang, Guilong; Zhang, Qiong; Li, Dandan; Wu, Jieying; Wu, Zhengyan; Zhang, Zhongping; Tian, Yupeng
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2019
• Journal volume: 6
• Journal issue: 10
• Pages of publication: 2914
• a: 10.897 ± 0.003 Å
• b: 10.372 ± 0.003 Å
• c: 29.943 ± 0.008 Å
• α: 90°
• β: 96.4 ± 0.004°
• γ: 90°
• Cell volume: 3363.2 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.1662
• Residual factor for significantly intense reflections: 0.0863
• Weighted residual factors for significantly intense reflections: 0.2481
• Weighted residual factors for all reflections included in the refinement: 0.2902
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No