Information card for entry 8105144

Structure parameters

• Formula: C66 H34 Er2 F12 N4 O12
• Calculated formula: C66 H34 Er2 F12 N4 O12
• Title of publication: The crystal structure of [(tetra-μ 2-2,6-difluorobenzoato-κ 2 O:O′)-bis-(2,6-difluorobenzoato-κ 2 O:O′)-bis-(1,10-phenanthroline-κ 2 N:N′)]dierbium(III) C66H34N4O12F12Er2
• Authors of publication: Yu-Fei, Zhong; Wen-Min, Wang; Xiong-Xin, Peng; Guang-Ming, Bao; Chun-Yan, Hu; Hou-Qun, Yuan
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2020
• Journal volume: 235
• Journal issue: 2
• Pages of publication: 473 - 475
• a: 11.8934 ± 0.0005 Å
• b: 12.0041 ± 0.0004 Å
• c: 12.4578 ± 0.0005 Å
• α: 68.718 ± 0.004°
• β: 64.205 ± 0.004°
• γ: 87.053 ± 0.003°
• Cell volume: 1480.09 ± 0.12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0426
• Residual factor for significantly intense reflections: 0.0326
• Weighted residual factors for significantly intense reflections: 0.0577
• Weighted residual factors for all reflections included in the refinement: 0.0626
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No