Information card for entry 4518580

Structure parameters

• Formula: C38 H28 Fe N7 O7
• Calculated formula: C38 H28 Fe N7 O7
• Title of publication: Fe-Based Coordination Polymers as Battery-Type Electrodes in Semi-Solid-State Battery-Supercapacitor Hybrid Devices.
• Authors of publication: Wang, Kuaibing; Wang, Saier; Liu, Jiadi; Guo, Yuxuan; Mao, Feifei; Wu, Hua; Zhang, Qichun
• Journal of publication: ACS applied materials & interfaces
• Year of publication: 2021
• a: 8.674 ± 0.0003 Å
• b: 11.896 ± 0.0004 Å
• c: 16.939 ± 0.0006 Å
• α: 90.744 ± 0.003°
• β: 103.308 ± 0.003°
• γ: 94.865 ± 0.003°
• Cell volume: 1693.85 ± 0.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0649
• Residual factor for significantly intense reflections: 0.0424
• Weighted residual factors for significantly intense reflections: 0.1089
• Weighted residual factors for all reflections included in the refinement: 0.1182
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No