Information card for entry 4004074

Structure parameters

• Formula: C32 H48 Ag Cl8 Fe N4
• Calculated formula: C32 H48 Ag Cl8 Fe N4
• Title of publication: Chemical Control of Magnetic Ordering in Hybrid Fe–Cl Layered Double Perovskites
• Authors of publication: Xue, Jie; Wang, Ziyu; Comstock, Andrew; Wang, Zhiyu; Sung, Herman H. Y.; Williams, Ian D.; Sun, Dali; Liu, Junwei; Lu, Haipeng
• Journal of publication: Chemistry of Materials
• Year of publication: 2022
• Journal volume: 34
• Journal issue: 6
• Pages of publication: 2813 - 2823
• a: 38.6306 ± 0.0011 Å
• b: 7.3226 ± 0.0003 Å
• c: 7.2843 ± 0.0002 Å
• α: 90°
• β: 90.585 ± 0.003°
• γ: 90°
• Cell volume: 2060.45 ± 0.12 ų
• Cell temperature: 173 ± 0.1 K
• Ambient diffraction temperature: 173 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0718
• Residual factor for significantly intense reflections: 0.0642
• Weighted residual factors for significantly intense reflections: 0.1678
• Weighted residual factors for all reflections included in the refinement: 0.1769
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No