Information card for entry 7718817

Structure parameters

• Formula: C215.5 H249.5 F24 Fe4 N56.5 O72 S8
• Calculated formula: C180 H131 Fe4 N48 O12
• Title of publication: Construction of a metal-organic tetrahedral cage for boosting selective electrocatalytic reduction of nitrite to ammonium.
• Authors of publication: Liu, Chang; Yang, Yang; Li, Xinyu; Wang, Jinfeng; Jing, Xu; Duan, Chunying
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 25
• Pages of publication: 9930 - 9936
• a: 25.7549 ± 0.0019 Å
• b: 27.8802 ± 0.0019 Å
• c: 28.4643 ± 0.0018 Å
• α: 108.206 ± 0.004°
• β: 92.582 ± 0.004°
• γ: 98.523 ± 0.004°
• Cell volume: 19110 ± 2 ų
• Cell temperature: 170 K
• Ambient diffraction temperature: 170 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.141
• Residual factor for significantly intense reflections: 0.1128
• Weighted residual factors for significantly intense reflections: 0.3604
• Weighted residual factors for all reflections included in the refinement: 0.416
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 1.34138 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No