Information card for entry 7248096

Structure parameters

• Formula: C54 H55 Co3 N6 O57 W12
• Calculated formula: C54 H44 Co3 N6 O52 W12
• Title of publication: Structure-induced selective adsorption of diverse dyes and Cr(vi) photoreduction using two new polyoxometalate-based metal–viologen complexes
• Authors of publication: Wang, Xiuli; Yang, Lin; Zhang, Zhong
• Journal of publication: CrystEngComm
• Year of publication: 2024
• Journal volume: 26
• Journal issue: 10
• Pages of publication: 1363 - 1370
• a: 14.5892 ± 0.0009 Å
• b: 21.9646 ± 0.0015 Å
• c: 26.1741 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8387.4 ± 0.9 ų
• Cell temperature: 296.15 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 6
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.1123
• Residual factor for significantly intense reflections: 0.0616
• Weighted residual factors for significantly intense reflections: 0.1243
• Weighted residual factors for all reflections included in the refinement: 0.1468
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No