Information card for entry 4323899

Structure parameters

• Formula: C21 H49 Cl3 Mo3 N15 O0.5 S13 Sn
• Calculated formula: C21 H48 Cl3 Mo3 N15 O0.5 S13 Sn
• Title of publication: Interconversion and Reactivity of Two Heterometallic Tin-Containing Cuboidal Clusters from [Mo3S4(H2O)9]4+: X-ray Structure of the Single Cube with an Mo3SnS4 Core
• Authors of publication: Jane E. Varey; Gert J. Lamprecht; Vladimir P. Fedin; Alvin Holder; William Clegg; Mark R. J. Elsegood; A. Geoffrey Sykes
• Journal of publication: Inorganic Chemistry
• Year of publication: 1996
• Journal volume: 35
• Pages of publication: 5525 - 5530
• a: 42.258 ± 0.014 Å
• b: 11.907 ± 0.003 Å
• c: 21.472 ± 0.005 Å
• α: 90°
• β: 94.449 ± 0.009°
• γ: 90°
• Cell volume: 10771 ± 5 ų
• Cell temperature: 160 ± 2 K
• Ambient diffraction temperature: 160 ± 2 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0934
• Residual factor for significantly intense reflections: 0.0817
• Weighted residual factors for all reflections: 0.1563
• Weighted residual factors for significantly intense reflections: 0.1518
• Goodness-of-fit parameter for all reflections: 1.434
• Goodness-of-fit parameter for significantly intense reflections: 1.461
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No