Information card for entry 1571623

Structure parameters

• Formula: C64 H36 Au4 Fe2 N16 O2
• Calculated formula: C64 H36 Au4 Fe2 N16 O2
• Title of publication: Bidirectional photomagnetism, exciplex fluorescence and dielectric anomalies in a spin crossover Hofmann-type coordination polymer.
• Authors of publication: Chen, Yan-Ru; Ying, Ting-Ting; Chen, Yan-Cong; Liao, Pei-Yu; Ni, Zhao-Ping; Tong, Ming-Liang
• Journal of publication: Chemical science
• Year of publication: 2024
• Journal volume: 15
• Journal issue: 24
• Pages of publication: 9240 - 9248
• a: 27.6016 ± 0.0006 Å
• b: 28.7074 ± 0.0008 Å
• c: 15.346 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 12159.7 ± 0.6 ų
• Cell temperature: 202.99 ± 0.1 K
• Ambient diffraction temperature: 202.99 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1351
• Residual factor for significantly intense reflections: 0.0899
• Weighted residual factors for significantly intense reflections: 0.1755
• Weighted residual factors for all reflections included in the refinement: 0.1985
• Goodness-of-fit parameter for all reflections included in the refinement: 1.163
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No