Information card for entry 4135433

Structure parameters

• Formula: C128 H199 F24 N6 O10 P12 Pt4
• Calculated formula: C128 H199 F24 N6 O10 P12 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: 30.224 ± 0.0002 Å
• b: 19.7501 ± 0.0001 Å
• c: 27.1586 ± 0.0002 Å
• α: 90°
• β: 92.612 ± 0.001°
• γ: 90°
• Cell volume: 16194.9 ± 0.18 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.01 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0804
• Residual factor for significantly intense reflections: 0.0736
• Weighted residual factors for significantly intense reflections: 0.1754
• Weighted residual factors for all reflections included in the refinement: 0.1804
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No