Information card for entry 7028186

Structure parameters

• Formula: C24 H49 Mo N18 O0.5 S16 W3
• Calculated formula: C24 H48 Mo0.9994 N18 O0.51 S16 W3.0006
• Title of publication: Preparation, structure and properties of three [MoxW4−xS4(H2O)12]5+ (x = 1‒3) and [MoW3Se4(H2O)12]5+ cuboidal complexes alongside [Mo4S4(H2O)12]5+ and [Mo4Se4(H2O)12]5+
• Authors of publication: McLean, Iain J.; Hernandez-Molina, Rita; Sokolov, Maxim N.; Seo, Mi-Sook; Virovets, Alexander V.; Elsegood, Mark R. J.; Clegg, William; Sykes, A. Geoffrey
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1998
• Journal issue: 15
• Pages of publication: 2557
• a: 22.759 ± 0.006 Å
• b: 22.759 ± 0.006 Å
• c: 22.759 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 11789 ± 5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 205
• Hermann-Mauguin space group symbol: P a -3
• Hall space group symbol: -P 2ac 2ab 3
• Residual factor for all reflections: 0.181
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for all reflections: 0.0646
• Weighted residual factors for significantly intense reflections: 0.0523
• Goodness-of-fit parameter for all reflections: 0.606
• Goodness-of-fit parameter for significantly intense reflections: 0.963
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No