Information card for entry 4347326

Structure parameters

• Formula: C26 H20 Ag Mo12 N8 O46 P
• Calculated formula: C26 H20 Ag Mo12 N8 O46 P
• SMILES: [Mo]1234([O]56=P78[O]9%10[Mo]%11%12%13(O[Mo]%14%159(O[Mo]9%10(O[Mo]%10%16%17(=O)O[Mo]%18%19(=O)(O[Mo]5(=O)(O3)(O[Mo]6(O[Mo]35(=O)([O]67[Mo](=O)(O[Mo](=O)([O]8%10%18)(O2)(O%16)O%19)(O3)(O4)O[Mo]6(=O)(O9)(O%17)O5)O%15)(O1)(=O)O%14)O%12)O%13)(O%11)=O)=O)=O)=O.O.n1(cc[n]([Ag][n]2cn(c3cc(n4cc[nH+]c4)cc(C(=O)[O-])c3)cc2)c1)c1cc(cc(n2c[nH+]cc2)c1)C(=O)[O-].O
• Title of publication: An Effective Strategy To Construct Novel Polyoxometalate-Based Hybrids by Deliberately Controlling Organic Ligand Transformation In Situ.
• Authors of publication: Wang, Xiu-Li; Zhang, Rui; Wang, Xiang; Lin, Hong-Yan; Liu, Guo-Cheng
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 13
• Pages of publication: 6384 - 6393
• a: 13.246 ± 0.005 Å
• b: 13.603 ± 0.005 Å
• c: 16.304 ± 0.005 Å
• α: 87.4 ± 0.005°
• β: 74.351 ± 0.005°
• γ: 88.125 ± 0.005°
• Cell volume: 2825.3 ± 1.7 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: 0.058
• Residual factor for significantly intense reflections: 0.0444
• Weighted residual factors for significantly intense reflections: 0.1089
• Weighted residual factors for all reflections included in the refinement: 0.1167
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No