Information card for entry 7057397

Structure parameters

• Formula: C53 H52 N6 O13 Tb2
• Calculated formula: C53 H52 N6 O13 Tb2
• Title of publication: Regulating the luminescent and magnetic properties of rare-earth complexes with β-diketonate coligands
• Authors of publication: Chu, Xiao-Ya; Wang, Wen-Min; Nie, Yao-Yao; Cui, Jian-Zhong; Gao, Hong-Ling
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 14
• Pages of publication: 11417
• a: 13.2673 ± 0.0014 Å
• b: 8.9523 ± 0.0009 Å
• c: 22.256 ± 0.002 Å
• α: 90°
• β: 92.579 ± 0.002°
• γ: 90°
• Cell volume: 2640.7 ± 0.5 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113.15 K
• Number of distinct elements: 5
• 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: 0.0464
• Residual factor for significantly intense reflections: 0.0404
• Weighted residual factors for significantly intense reflections: 0.0967
• Weighted residual factors for all reflections included in the refinement: 0.1025
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No