Information card for entry 7709331

Structure parameters

• Formula: C55 H58 Mo12 N12 O40.5 P Zn2
• Calculated formula: C55 H56 Mo12 N12 O40.5 P Zn2
• Title of publication: Two POM-based compounds containing Zn-capped Keggin anions as decent heterogeneous catalysts for sulfur oxidation and cycloaddition of CO2 reactions
• Authors of publication: Zhu, Yinhua; Yang, Jianbo; Liu, Xiaomei; Wang, Jilei; Ping, Qingdong; Du, Zeyu; Li, Jianian; Zang, Tingting; Mei, Hua; Xu, Yan
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 23.936 ± 0.002 Å
• b: 18.22 ± 0.002 Å
• c: 19.26 ± 0.002 Å
• α: 90°
• β: 106.755 ± 0.002°
• γ: 90°
• Cell volume: 8043 ± 1.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0301
• Residual factor for significantly intense reflections: 0.0253
• Weighted residual factors for significantly intense reflections: 0.0595
• Weighted residual factors for all reflections included in the refinement: 0.0612
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No