Information card for entry 4324709

Structure parameters

• Formula: C4 H62 Ag As2 Mo15 N13 O60
• Calculated formula: C4 Ag As2 Mo15 N2 O71
• SMILES: C(#N)C.O=[Mo]1234(O[Mo]564([O]1[As]14[O]7[Mo]89(O2)(=O)(=O)[Mo]27(O8)(=O)(=O)O[Mo]78%10([O]4[Mo]7(O6)(=O)(=O)(O8)[O]%10[Mo@@]4(=O)O[Mo]678([Mo]%10(O[Mo]%11%12%13([Mo]%14(O[Mo@]([O]92)(=O)O%11)(O[Mo]29(O[Mo]([O]35)(=O)O[Mo](O2)([O]9[As]([Ag]1)([O]%12%14)[O]7%10)(=O)(=O)O6)(=O)=O)(=O)(O%13)=O)(=O)=O)(O4)(=O)(O8)=O)(=O)=O)(=O)=O)(=O)=O)=O.O.O.O.O.O.O.O.O.O.O.O.C(#N)C.O.O.O.O.O.O
• Title of publication: A Cagelike Polyanion with a Ag+ Enwrapped, [AgAs2Mo15O54]11-
• Authors of publication: Yanping Zhang; Lili Li; Tao Sun; Bin Liu; Huaiming Hu; Ganglin Xue
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 2613 - 2618
• a: 25.144 ± 0.008 Å
• b: 19.41 ± 0.006 Å
• c: 13.355 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6518 ± 4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.1043
• Residual factor for significantly intense reflections: 0.0606
• Weighted residual factors for significantly intense reflections: 0.1583
• Weighted residual factors for all reflections included in the refinement: 0.1692
• Goodness-of-fit parameter for all reflections included in the refinement: 0.995
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No