Information card for entry 7128913

Structure parameters

• Formula: C70 H84 F6 N4 O22 Rh2 S2
• Calculated formula: C64 H62 F6 N4 O18 Rh2 S2
• Title of publication: Same knot, longer rope: altering ligand geometry provides control over nuclearity in self-assembled trefoil knots.
• Authors of publication: Wang, Qi-Li-Sha; Lin, Yue-Jian; Jin, Guo-Xin
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 76
• Pages of publication: 9772 - 9775
• a: 11.7168 ± 0.0009 Å
• b: 16.8296 ± 0.0012 Å
• c: 20.3839 ± 0.0014 Å
• α: 68.846 ± 0.004°
• β: 87.425 ± 0.004°
• γ: 87.035 ± 0.004°
• Cell volume: 3742.1 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0517
• Residual factor for significantly intense reflections: 0.0447
• Weighted residual factors for significantly intense reflections: 0.1269
• Weighted residual factors for all reflections included in the refinement: 0.132
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No