Information card for entry 4128521

Structure parameters

• Formula: C275 H237 B9 Cl Co5 F36 N34
• Calculated formula: C275 H237 B9 Cl Co5 F36 N34
• Title of publication: Coordination Chemistry of a Molecular Pentafoil Knot.
• Authors of publication: Zhang, Liang; Stephens, Alexander J.; Lemonnier, Jean-François; Pirvu, Lucian; Vitorica-Yrezabal, Iñigo J; Robinson, Christopher J.; Leigh, David A.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 9
• Pages of publication: 3952 - 3958
• a: 22.1116 ± 0.0017 Å
• b: 28.081 ± 0.002 Å
• c: 28.5729 ± 0.0017 Å
• α: 61.443 ± 0.007°
• β: 87.521 ± 0.006°
• γ: 67.458 ± 0.007°
• Cell volume: 14176 ± 2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.182
• Residual factor for significantly intense reflections: 0.1195
• Weighted residual factors for significantly intense reflections: 0.3161
• Weighted residual factors for all reflections included in the refinement: 0.3584
• Goodness-of-fit parameter for all reflections included in the refinement: 1.133
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.6889 Å
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No