Information card for entry 7710455

Structure parameters

• Formula: C42 H54 F9 N9 O9 S9 Zn3
• Calculated formula: C42 H54 F9 N9 O9 S9 Zn3
• Title of publication: Cluster Self-Assembly and Anion Binding by Metal Complexes of Non-Innocent Thiazolidinyl-Thiolate Ligands
• Authors of publication: Riffel, Madeline N.; Siegel, Lukas; Oliver, Allen Grayson; Tsui, Emily Y.
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 12.1151 ± 0.001 Å
• b: 12.5801 ± 0.0011 Å
• c: 23.7692 ± 0.0019 Å
• α: 91.153 ± 0.003°
• β: 104.608 ± 0.003°
• γ: 116.404 ± 0.003°
• Cell volume: 3103.1 ± 0.5 ų
• Cell temperature: 119.98 K
• Ambient diffraction temperature: 119.98 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: 0.0347
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.0707
• Weighted residual factors for all reflections included in the refinement: 0.0723
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No