Information card for entry 7028023

Structure parameters

• Chemical name: Tetralithium-hexakis(2-methoxyethoxy)-tetrakis(2- -methoxyethanol)-tetraoxo-di-tungsten hexawolframate
• Formula: C30 H74 Li4 O43 W8
• Calculated formula: C30 H74 Li4 O43 W8
• SMILES: [Li]123([O](CC[OH]1)C)([O](CC[OH]2)C)[O]=[W]1(=[O]3)([O](CC[O]2C)[W]([O]1CC[O]1C)(=O[Li]345([O](CC[OH]4)C)[O](CC[OH]5)C)(=[O]3)([O]([Li]1345)CC[O]5C)[O]3CC[O]4C)([O]([Li]2134)CC[O]1C)[O]3CC[O]4C.[W]1234(=O)O[W]567([O]89%101[W]1%11(O[W]%10(=O)(O[W]8(O[W]9(=O)(O5)(O2)O1)(=O)(O%11)O4)(O6)O3)(=O)O7)=O
• Title of publication: Anodic oxidation of molybdenum and tungsten in alcohols: isolation and X-ray single-crystal study of side products
• Authors of publication: Kessler, Vadim G.; Panov, Andrei N.; Turova, Nataliya Ya.; Starikova, Zoya A.; Yanovsky, Alexandr I.; Dolgushin, Fedor M.; Pisarevsky, Alexandr P.; Struchkov, Yuri T.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1998
• Journal issue: 1
• Pages of publication: 21
• a: 11.461 ± 0.005 Å
• b: 11.828 ± 0.004 Å
• c: 12.623 ± 0.005 Å
• α: 89.9 ± 0.03°
• β: 110.73 ± 0.03°
• γ: 103.01 ± 0.03°
• Cell volume: 1553.6 ± 1.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0893
• Residual factor for significantly intense reflections: 0.0591
• Weighted residual factors for all reflections: 0.1761
• Weighted residual factors for significantly intense reflections: 0.1594
• Goodness-of-fit parameter for all reflections: 0.976
• Goodness-of-fit parameter for significantly intense reflections: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No