Information card for entry 4321290

Structure parameters

• Formula: C104.5 H160 Mg2 O2 S4
• Calculated formula: C79.97 H131.91 Mg2 O2 S4
• Title of publication: Syntheses, Structures, and Reactivities of Heteroleptic Magnesium Amide Thiolates
• Authors of publication: Weijie Teng; Ulrich Englich; Karin Ruhlandt-Senge
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 3875 - 3880
• a: 18.8806 ± 0.0002 Å
• b: 19.385 ± 0.0002 Å
• c: 27.3012 ± 0.0004 Å
• α: 90°
• β: 97.25 ± 0.001°
• γ: 90°
• Cell volume: 9912.4 ± 0.2 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1023
• Residual factor for significantly intense reflections: 0.0764
• Weighted residual factors for significantly intense reflections: 0.1903
• Weighted residual factors for all reflections included in the refinement: 0.2043
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No