Information card for entry 7248212

Structure parameters

• Formula: C120 H163 Ag2 N34 O50 P S16 W12
• Calculated formula: C112 H145 Ag2 N32 O48 P S16 W12
• Title of publication: Highly efficient photoelectrocatalytic oxidation of arsenic(iii) with a polyoxometalate-thiacalix[4]arene-based metal–organic complex-modified bismuth vanadate photoanode
• Authors of publication: Song, Yuting; Zhang, Jia-Yi; Yang, Jin; Bo, Tao; Ma, Jian-Fang
• Journal of publication: Green Chemistry
• Year of publication: 2024
• Journal volume: 26
• Journal issue: 7
• Pages of publication: 3874 - 3883
• a: 12.6937 ± 0.0006 Å
• b: 18.449 ± 0.0008 Å
• c: 19.5975 ± 0.0007 Å
• α: 75.711 ± 0.004°
• β: 77.491 ± 0.004°
• γ: 88.11 ± 0.004°
• Cell volume: 4340.9 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0969
• Residual factor for significantly intense reflections: 0.0556
• Weighted residual factors for significantly intense reflections: 0.1062
• Weighted residual factors for all reflections included in the refinement: 0.1277
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No