Information card for entry 7249778

Structure parameters

• Formula: C0.02 H0.02 Cu N0.02 O W
• Calculated formula: C4.09756 H6.43902 Cu0.0174634 N1.17073 O4.19512 W1.17073
• Title of publication: Three-dimensional 14-core manganese-sodium-based polyoxometalate with unique channels as bifunctional electrocatalysts for overall water splitting
• Authors of publication: Gong, Lige; Wang, Meijia; Wang, Jihua; Dong, Limin; Gu, Yunhao; Yang, Binghe; Li, Hui
• Journal of publication: CrystEngComm
• Year of publication: 2025
• Journal volume: 27
• Journal issue: 7
• Pages of publication: 974 - 988
• a: 13.7848 ± 0.0005 Å
• b: 20.9048 ± 0.0007 Å
• c: 26.7438 ± 0.0009 Å
• α: 90°
• β: 97.288 ± 0.001°
• γ: 90°
• Cell volume: 7644.5 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• 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: 0.0816
• Residual factor for significantly intense reflections: 0.0651
• Weighted residual factors for significantly intense reflections: 0.1874
• Weighted residual factors for all reflections included in the refinement: 0.2059
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No