Information card for entry 4135434

Structure parameters

• Formula: C134 H194 B4 F16 N6 O8 P8 Pt4
• Calculated formula: C134 H194 B4 F16 N6 O8 P8 Pt4
• Title of publication: TEMPO Radical-Functionalized Supramolecular Coordination Complexes with Controllable Spin-Spin Interactions.
• Authors of publication: Jiang, Wei-Ling; Peng, Zhiyong; Huang, Bin; Zhao, Xiao-Li; Sun, Di; Shi, Xueliang; Yang, Hai-Bo
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2020
• a: 12.0853 ± 0.0005 Å
• b: 18.1737 ± 0.0009 Å
• c: 19.882 ± 0.0006 Å
• α: 107.001 ± 0.003°
• β: 90.638 ± 0.003°
• γ: 94.11 ± 0.004°
• Cell volume: 4162.8 ± 0.3 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 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: 0.1296
• Residual factor for significantly intense reflections: 0.0998
• Weighted residual factors for significantly intense reflections: 0.2524
• Weighted residual factors for all reflections included in the refinement: 0.2742
• Goodness-of-fit parameter for all reflections included in the refinement: 0.972
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No