Information card for entry 4349762

Structure parameters

• Formula: C54 H5 Co D18 F26 N4 O11 P3 Yb
• Calculated formula: C54 H5 Co D18 F26 N4 O11 P3 Yb
• Title of publication: β-Fluorinated porpholactones and metal complexes: synthesis, characterization and some spectroscopic studies
• Authors of publication: Hu, Ji-Yun; Wu, Zhuo-Yan; Chai, Ke; Yang, Zi-Shu; Meng, Yin-Shan; Ning, Yingying; Zhang, Jing; Zhang, Jun-Long
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2017
• Journal volume: 4
• Journal issue: 9
• Pages of publication: 1539
• a: 24.4325 ± 0.0006 Å
• b: 10.159 ± 0.0002 Å
• c: 24.4872 ± 0.0006 Å
• α: 90°
• β: 92.014 ± 0.002°
• γ: 90°
• Cell volume: 6074.2 ± 0.2 ų
• Cell temperature: 180 ± 0.1 K
• Ambient diffraction temperature: 180 ± 0.1 K
• Number of distinct elements: 9
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0537
• Residual factor for significantly intense reflections: 0.0397
• Weighted residual factors for significantly intense reflections: 0.0914
• Weighted residual factors for all reflections included in the refinement: 0.1013
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No