Information card for entry 7134568

Structure parameters

• Formula: C254 H351 Cl5 Fe20 N12 O65 S20 V8
• Calculated formula: C228 H288 Cl5 Fe20 N4 O56 S20 V8
• Title of publication: Thiacalixarene-supported M20V8 (M = Fe, Co, Ni) square pyramid nanocages for visible light photothermal catalysis
• Authors of publication: Li, Qiqi; Zou, Yuhan; Mao, Dongao; Tian, Hongrui; Hang, Xinxin; Bi, Yanfeng
• Journal of publication: Chemical Communications
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 51
• Pages of publication: 9266 - 9269
• a: 26.9722 ± 0.0013 Å
• b: 26.9722 ± 0.0013 Å
• c: 22.8711 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 16638.7 ± 1.5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• Space group number: 79
• Hermann-Mauguin space group symbol: I 4
• Hall space group symbol: I 4
• Residual factor for all reflections: 0.0496
• Residual factor for significantly intense reflections: 0.0459
• Weighted residual factors for significantly intense reflections: 0.1372
• Weighted residual factors for all reflections included in the refinement: 0.1415
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No