Information card for entry 7048798

Structure parameters

• Formula: C6 H69 Co2 K5 Na4 O100 Sb2 Sn2 W18
• Calculated formula: C6 H56 Co2 K5 Na4 O100 Sb2 Sn2 W18
• SMILES: C1CC(=O)O[Sn]2341[O]=[W]1567=[O][Sn]89%10(CCC(=O)O8)[O]=[W]8%11(=[O]2)(=[O][Co]2([OH2])([OH2])([O]=[W]%12%13%14(O[W]%15%16([O]%17%18[Sb]%19[O]%206[W]6%21(O5)([O][W]5%20(O[W]%20(=O)(O%12)(O[W](O5)(=O)([O]%13%19%20)(O%14)O[W]%17(O[W]%18(O6)(=O)(=[O]%10)O%16)(=O)(O%15)O%21)=[O]3)(=O)O7)=O)(=O)=[O]2)=O)[OH2])O[W]235(=O)O[W]67(O[W]%10%12(O2)(=O)[O]26[Sb]6[O]83[W]3(O[W]8%13(O[W]%14%15(O[W]2(O%12)(=O)(=[O][Co]([O]=1)([OH2])([OH2])([O]=%14)[OH2])O7)([O]68[W](O3)(=O)(O%13)(O%15)O%10)=O)(=O)=[O]9)(=O)(O%11)O5)(=O)=[O]4.O.[K+].O.O.[Na+].O.O.O.O.O.O.[K+].O.O.[Na+].O.[K+].O.O.O.[Na+].O.[K+].O.O.[Na+].O.O.O.O.O.O.[K+]
• Title of publication: Carboxyethyltin and transition metal co-functionalized tungstoantimonates composited with polypyrrole for enhanced electrocatalytic methanol oxidation.
• Authors of publication: Wang, Hai-Dan; Wang, Xing-Fang; Su, Fang; Li, Jian-Sheng; Zhang, Lan-Cui; Sang, Xiao-Jing; Zhu, Zai-Ming
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 9
• Pages of publication: 2977 - 2987
• a: 12.4391 ± 0.0012 Å
• b: 12.6196 ± 0.0012 Å
• c: 16.3813 ± 0.0016 Å
• α: 94.581 ± 0.002°
• β: 109.896 ± 0.002°
• γ: 101.759 ± 0.002°
• Cell volume: 2335.9 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0562
• Residual factor for significantly intense reflections: 0.0365
• Weighted residual factors for significantly intense reflections: 0.0715
• Weighted residual factors for all reflections included in the refinement: 0.0788
• Goodness-of-fit parameter for all reflections included in the refinement: 0.979
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No