Information card for entry 7249716

Structure parameters

• Formula: C12 H8 Fe N4 O10
• Calculated formula: C12 H8 Fe N4 O10
• Title of publication: Exploration of a one-dimensional iron-based coordination polymer for enhanced lithium storage capabilities
• Authors of publication: Liu, Jingwei; Cheng, Xiaolong; Dang, Shifa; Kong, Weile; Zheng, Mengxian; Zhang, Lei; Wu, Shuangyan; Liu, Ning; Cao, Jinchao
• Journal of publication: CrystEngComm
• Year of publication: 2025
• Journal volume: 27
• Journal issue: 5
• Pages of publication: 687 - 694
• a: 14.9219 ± 0.0019 Å
• b: 8.4923 ± 0.0007 Å
• c: 13.0852 ± 0.0017 Å
• α: 90°
• β: 118.145 ± 0.017°
• γ: 90°
• Cell volume: 1462.1 ± 0.4 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.0707
• Residual factor for significantly intense reflections: 0.0465
• Weighted residual factors for significantly intense reflections: 0.1151
• Weighted residual factors for all reflections included in the refinement: 0.1241
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No