Information card for entry 4128722

Structure parameters

• Formula: C104 H140 F12 N12 O38 Pd2 Rh4 S6
• Calculated formula: C91.6667 H92 F7 N12 O19.6667 Pd2 Rh4 S3
• Title of publication: Covalent Post-assembly Modification Triggers Structural Transformations of Borromean Rings.
• Authors of publication: Gao, Wen-Xi; Feng, Hui-Jun; Lin, Yue-Jian; Jin, Guo-Xin
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 23
• Pages of publication: 9160 - 9164
• a: 42.412 ± 0.009 Å
• b: 24.783 ± 0.005 Å
• c: 37.548 ± 0.008 Å
• α: 90°
• β: 93.396 ± 0.004°
• γ: 90°
• Cell volume: 39397 ± 14 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1613
• Residual factor for significantly intense reflections: 0.0923
• Weighted residual factors for significantly intense reflections: 0.2458
• Weighted residual factors for all reflections included in the refinement: 0.3084
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No