Information card for entry 7700833

Structure parameters

• Formula: C60 H53 Cl4 Fe4 Gd2 N13 O20
• Calculated formula: C60 H53 Cl4 Fe4 Gd2 N13 O20
• Title of publication: Synthesis, crystal structures and magnetic properties of a series of chair-like heterometallic [Fe₄Ln₂] (Ln = Gd^III, Dy^III, Ho^III, and Er^III) complexes with mixed organic ligands.
• Authors of publication: Wang, Hui-Sheng; Long, Qiao-Qiao; Hu, Zhao-Bo; Yue, Lin; Yang, Feng-Jun; Yin, Cheng-Ling; Pan, Zhi-Quan; Zhang, Yi-Quan; Song, You
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 35
• Pages of publication: 13472 - 13482
• a: 13.9064 ± 0.0005 Å
• b: 15.7148 ± 0.0005 Å
• c: 20.7911 ± 0.0008 Å
• α: 81.369 ± 0.001°
• β: 83.203 ± 0.001°
• γ: 66.034 ± 0.001°
• Cell volume: 4096.6 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0698
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for significantly intense reflections: 0.0597
• Weighted residual factors for all reflections included in the refinement: 0.0632
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No