Information card for entry 7246894

Structure parameters

• Formula: C77.78 H76.08 B F4 N13.89 O18.94 Zn3
• Calculated formula: C77.7736 H76.0746 B F4 N13.8884 O18.9434 Zn3
• Title of publication: Anion-dependent dynamic structure and tunable luminescence of Zn-MOFs with carboxyphenyl-terpyridine ligands
• Authors of publication: Guo, Runzhong; Liu, Yuchen; Wang, Zhibin; Wang, Haiying; Liu, Huiyan
• Journal of publication: CrystEngComm
• Year of publication: 2023
• Journal volume: 25
• Journal issue: 29
• Pages of publication: 4157 - 4166
• a: 15.521 ± 0.007 Å
• b: 21.92 ± 0.011 Å
• c: 23.657 ± 0.011 Å
• α: 90°
• β: 101.131 ± 0.006°
• γ: 90°
• Cell volume: 7897 ± 6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 7
• 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: 0.0945
• Residual factor for significantly intense reflections: 0.0539
• Weighted residual factors for significantly intense reflections: 0.1359
• Weighted residual factors for all reflections included in the refinement: 0.1551
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No