Information card for entry 4308081

Structure parameters

• Formula: Br20 Mo6 Se14 Te4
• Calculated formula: Br20 Mo6 Se14 Te4
• Title of publication: Synthesis and Structures of Mo3Se7Te2Br10, Mo3Se7TeI6, and Mo6Te21I22 Containing TeX3- (X = Br, I) Ligands Coordinated to a Triangular Cluster Core
• Authors of publication: Maxim N. Sokolov; Artem L. Gushchin; Pavel A. Abramov; Alexander V. Virovets; Eugenia V. Peresypkina; Vladimir P. Fedin
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 4677 - 4682
• a: 10.1638 ± 0.0004 Å
• b: 11.0421 ± 0.0004 Å
• c: 12.52 ± 0.0004 Å
• α: 85.461 ± 0.002°
• β: 85.529 ± 0.002°
• γ: 76.41 ± 0.002°
• Cell volume: 1358.93 ± 0.09 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0732
• Residual factor for significantly intense reflections: 0.042
• Weighted residual factors for significantly intense reflections: 0.1022
• Weighted residual factors for all reflections included in the refinement: 0.1176
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No