Information card for entry 7134569

Structure parameters

• Formula: C262 H375 Cl5 N12 Ni20 O69 S20 V8
• Calculated formula: C254 H350 Cl5 N12 Ni20 O65 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: 26.771 ± 0.002 Å
• b: 26.771 ± 0.002 Å
• c: 23.0428 ± 0.0019 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 16514 ± 2 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: 0.0409
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.1049
• Weighted residual factors for all reflections included in the refinement: 0.1075
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No