Information card for entry 7033457

Structure parameters

• Formula: C48 H55 N12 O46 Si W11 Zn
• Calculated formula: C48 H45 N12 O41 Si W11 Zn
• SMILES: [W]1234(=O)O[W]567([O]81[W]1(O[W]9%10%11(O[Zn]%12%13([n]%14c%15ccccc%15[nH]c%14c%14ccncc%14)O[W]%14%15%16([O]%17%18[W]%19(O[W]%20%21(O2)(O[W]2([O]%20([W](=O)(O2)(O%21)(O%12)O%16)[Si]8%18[O]9[W](O6)(=O)(O[W]%17(O%19)(O%14)(=O)O7)(O%13)O%11)(=O)(O1)O%10)=O)(=O)(O3)O%15)=O)=O)(=O)(O5)O4)=O.O.O.[nH]1c2c([nH+]c1c1cc[nH+]cc1)cccc2.[nH]1c2ccccc2[nH+]c1c1ccncc1.[nH]1c2ccccc2[nH+]c1c1cc[nH+]cc1
• Title of publication: The loading of coordination complex modified polyoxometalate nanobelts on activated carbon fiber: a feasible strategy to obtain visible light active and highly efficient polyoxometalate based photocatalysts.
• Authors of publication: Lu, Tingting; Xu, Xinxin; Li, Huili; Li, Zhenyu; Zhang, Xia; Ou, Jinzhao; Mei, Mingliang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 5
• Pages of publication: 2267 - 2275
• a: 13.1329 ± 0.0006 Å
• b: 14.3222 ± 0.0006 Å
• c: 23.9745 ± 0.001 Å
• α: 77.751 ± 0.001°
• β: 79.053 ± 0.001°
• γ: 66.483 ± 0.001°
• Cell volume: 4012.8 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0663
• Residual factor for significantly intense reflections: 0.0556
• Weighted residual factors for significantly intense reflections: 0.1663
• Weighted residual factors for all reflections included in the refinement: 0.1762
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No