Information card for entry 4128338

Structure parameters

• Formula: C210 H228 Ag2 F18 Ir6 N24 O26 S6
• Calculated formula: C191.5 H182 Ag2 F10.5 Ir6 N22 O10.5 S3.5
• Title of publication: Reversible Structural Transformation between a Molecular Solomon Link and an Unusual Unsymmetrical Trefoil Knot.
• Authors of publication: Zhang, Hai-Ning; Gao, Wen-Xi; Lin, Yue-Jian; Jin, Guo-Xin
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 40
• Pages of publication: 16057 - 16063
• a: 28.2902 ± 0.0019 Å
• b: 21.3553 ± 0.0016 Å
• c: 36.871 ± 0.003 Å
• α: 90°
• β: 101.089 ± 0.003°
• γ: 90°
• Cell volume: 21860 ± 3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 172.99 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0778
• Residual factor for significantly intense reflections: 0.0589
• Weighted residual factors for significantly intense reflections: 0.1645
• Weighted residual factors for all reflections included in the refinement: 0.1794
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No