Information card for entry 7061979

Structure parameters

• Formula: C24 H16 Cl6 Fe2 N6
• Calculated formula: C24 H16 Cl6 Fe2 N6
• Title of publication: FeII, CoII and NiII complexes based on 1-chloro-3-(pyridin-2-yl)imidazo[1,5-a]pyridine: synthesis, structures, single-molecule magnetic and electrocatalytic properties
• Authors of publication: Zhang, Xiamei; He, Chengying; Yang, Xiaohan; Zhang, Qian; Li, Yahong; Yao, Jinlei
• Journal of publication: New Journal of Chemistry
• Year of publication: 2022
• Journal volume: 46
• Journal issue: 45
• Pages of publication: 21780 - 21787
• a: 8.7152 ± 0.0018 Å
• b: 20.968 ± 0.004 Å
• c: 14.998 ± 0.003 Å
• α: 90°
• β: 95.645 ± 0.006°
• γ: 90°
• Cell volume: 2727.4 ± 0.9 ų
• Cell temperature: 147.06 K
• Ambient diffraction temperature: 147.06 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0504
• Residual factor for significantly intense reflections: 0.0395
• Weighted residual factors for significantly intense reflections: 0.1065
• Weighted residual factors for all reflections included in the refinement: 0.1192
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No