Information card for entry 7711251

Structure parameters

• Chemical name: Tb-DBTA
• Formula: C21 H24 Br3 N3 O9 Tb
• Calculated formula: C21 H24 Br3 N3 O9 Tb
• Title of publication: Design of “turn-off” luminescent Ln-MOFs for sensitive detection of cyanide anion
• Authors of publication: Liu, Weisai; Wang, Fei; Chen, Xiaoyi; Zhi, Wenke; Wang, Xuquan; Xu, Baoqiang; Yang, Bin
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 11.2415 ± 0.0003 Å
• b: 11.552 ± 0.0003 Å
• c: 12.9279 ± 0.0004 Å
• α: 109.079 ± 0.003°
• β: 114.551 ± 0.003°
• γ: 97.782 ± 0.002°
• Cell volume: 1369.46 ± 0.09 ų
• Cell temperature: 150.04 ± 0.1 K
• Ambient diffraction temperature: 150.04 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.053
• Residual factor for significantly intense reflections: 0.0414
• Weighted residual factors for significantly intense reflections: 0.1041
• Weighted residual factors for all reflections included in the refinement: 0.1094
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No