Information card for entry 7700528

Structure parameters

• Formula: C228 H254 N28 O81 Zn16
• Calculated formula: C228 H253.998 N28 O80.9988 Zn16
• Title of publication: A cationic tetrahedral Zn(ii) cluster based on a new salicylamide imine multidentate ligand: synthesis, structure and fluorescence sensing study.
• Authors of publication: Meng, Huan-Huan; Wang, Cai-Yun; Xi, Wei; Song, Xue-Qin; Wang, Li
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 32
• Pages of publication: 12326 - 12335
• a: 22.5919 ± 0.0001 Å
• b: 22.5919 ± 0.0001 Å
• c: 22.5919 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 11530.8 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 205
• Hermann-Mauguin space group symbol: P a -3
• Hall space group symbol: -P 2ac 2ab 3
• Residual factor for all reflections: 0.0408
• Residual factor for significantly intense reflections: 0.0325
• Weighted residual factors for significantly intense reflections: 0.0846
• Weighted residual factors for all reflections included in the refinement: 0.0915
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No