Information card for entry 7038321

Structure parameters

• Formula: C80 H58 N5 O20 Tb3
• Calculated formula: C76 H48.334 N4 O19 Tb3
• Title of publication: Reversible metal-induced emission and chromaticity switching in isostructural Ln-MOFs.
• Authors of publication: Tong, Yue; Han, Xiao; Huang, Chao; Shao, Zhichao; Guo, Li'an; Wang, Yazhen; Ding, Jie; Hou, Hongwei
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 9
• Pages of publication: 3702 - 3705
• a: 13.3571 ± 0.0002 Å
• b: 15.1847 ± 0.0002 Å
• c: 18.275 ± 0.0003 Å
• α: 90°
• β: 103.632 ± 0.001°
• γ: 90°
• Cell volume: 3602.18 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0792
• Residual factor for significantly intense reflections: 0.073
• Weighted residual factors for significantly intense reflections: 0.1939
• Weighted residual factors for all reflections included in the refinement: 0.2001
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No