Information card for entry 4308622

Structure parameters

• Formula: C24 H60 Mo4 O12 P6 S12 Se4
• Calculated formula: C24 H60 Mo4 O12 P6 S12 Se4
• Title of publication: Preparation and Properties of the Full Series of Cuboidal Clusters [MoxW4-xSe4(H2O)12]n+ (n= 4-6) and Their Derivatives
• Authors of publication: M. Sokolov; P. Esparza; R. Hernandez-Molina; J. G. Platas; A. Mederos; J. A. Gavin; R. Llusar; C. Vicent
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 1132 - 1141
• a: 13.3753 ± 0.001 Å
• b: 13.899 ± 0.002 Å
• c: 16.467 ± 0.003 Å
• α: 72.204 ± 0.005°
• β: 87.584 ± 0.005°
• γ: 84.193 ± 0.005°
• Cell volume: 2899.6 ± 0.7 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0639
• Residual factor for significantly intense reflections: 0.0407
• Weighted residual factors for significantly intense reflections: 0.1035
• Weighted residual factors for all reflections included in the refinement: 0.1315
• Goodness-of-fit parameter for all reflections included in the refinement: 1.157
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No