Information card for entry 1557376

Structure parameters

• Formula: C22 H14 Au2 Fe N6
• Calculated formula: C22 H14 Au2 Fe N6
• Title of publication: Light- and temperature-assisted spin state annealing: accessing the hidden multistability
• Authors of publication: Chen, Yan-Cong; Meng, Yan; Dong, Yan-Jie; Song, Xiao-Wei; Huang, Guo-Zhang; Zhang, Chuan-Lei; Ni, Zhao-Ping; Navařík, Jakub; Malina, Ondřej; Zbořil, Radek; Tong, Ming-Liang
• Journal of publication: Chemical Science
• Year of publication: 2020
• Journal volume: 11
• Journal issue: 12
• Pages of publication: 3281 - 3289
• a: 10.8116 ± 0.0005 Å
• b: 14.4381 ± 0.0006 Å
• c: 14.9803 ± 0.0007 Å
• α: 90°
• β: 96.596 ± 0.002°
• γ: 90°
• Cell volume: 2322.93 ± 0.18 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0366
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.0704
• Weighted residual factors for all reflections included in the refinement: 0.0745
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No