Information card for entry 4336408

Structure parameters

• Formula: C65.5 H124 Cl Er3 Fe7 N22 O36
• Calculated formula: C65.5 H103 Cl Er3 Fe7 N22 O36
• Title of publication: Synthesis, Magnetism, and 57Fe Mössbauer Spectroscopic Study of a Family of [Ln3Fe7] Coordination Clusters (Ln = Gd, Tb, and Er)
• Authors of publication: Ghulam Abbas; Yanhua Lan; Valeriu Mereacre; Gernot Buth; Moulay T. Sagrati; Fernande Grandjean; Gary J. Long; Christopher E. Anson; Annie K. Powell
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 11767 - 11777
• a: 14.1532 ± 0.0002 Å
• b: 17.1938 ± 0.0004 Å
• c: 21.1108 ± 0.0004 Å
• α: 90.405 ± 0.002°
• β: 92.299 ± 0.001°
• γ: 98.269 ± 0.001°
• Cell volume: 5079.33 ± 0.17 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0963
• Residual factor for significantly intense reflections: 0.0661
• Weighted residual factors for significantly intense reflections: 0.1723
• Weighted residual factors for all reflections included in the refinement: 0.1863
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No