Information card for entry 7037411

Structure parameters

• Formula: C50 H40 N6 O11 Tb
• Calculated formula: C50 H40 N6 O11 Tb
• Title of publication: A new TPE-based tetrapodal ligand and its Ln(iii) complexes: multi-stimuli responsive AIE (aggregation-induced emission)/ILCT(intraligand charge transfer)-bifunctional photoluminescence and NIR emission sensitization.
• Authors of publication: Zhu, Yi-Xuan; Wei, Zhang-Wen; Pan, Mei; Wang, Hai-Ping; Zhang, Jian-Yong; Su, Cheng-Yong
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 3
• Pages of publication: 943 - 950
• a: 28.363 Å
• b: 17.009 Å
• c: 15.655 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7552.38 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 50
• Hermann-Mauguin space group symbol: P b a n
• Hall space group symbol: -P 2ab 2b
• Residual factor for all reflections: 0.1388
• Residual factor for significantly intense reflections: 0.0831
• Weighted residual factors for significantly intense reflections: 0.2204
• Weighted residual factors for all reflections included in the refinement: 0.2464
• Goodness-of-fit parameter for all reflections included in the refinement: 0.946
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No