Information card for entry 7714951

Structure parameters

• Formula: C61 H69 Cl6 Fe8 Gd2 N10 O50
• Calculated formula: C61 H69 Cl6 Fe8 Gd2 N10 O50
• Title of publication: Single-molecule magnet behavior in heterometallic decanuclear [Ln₂Fe₈] (Ln = Y, Dy, Ho, Tb, Gd) coordination clusters.
• Authors of publication: Chen, Man-Ting; Zhao, Hai-Xia; Long, La-Sheng; Zheng, Lan-Sun
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 7
• Pages of publication: 3097 - 3103
• a: 13.863 ± 0.0003 Å
• b: 13.5261 ± 0.0003 Å
• c: 27.5985 ± 0.0004 Å
• α: 90°
• β: 91.729 ± 0.002°
• γ: 90°
• Cell volume: 5172.7 ± 0.18 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• 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: 0.0999
• Residual factor for significantly intense reflections: 0.0875
• Weighted residual factors for significantly intense reflections: 0.241
• Weighted residual factors for all reflections included in the refinement: 0.2629
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No