Information card for entry 4319297

Structure parameters

• Formula: C26 H16 F15 O2 S3 Sm
• Calculated formula: C26 H16 F15 O2 S3 Sm
• Title of publication: Fluorinated Thiolates of Divalent and Trivalent Lanthanides. Ln-F Bonds and the Synthesis of LnF3
• Authors of publication: Jonathan H. Melman; Thomas J. Emge; John G. Brennan
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 1078 - 1081
• a: 11.923 ± 0.01 Å
• b: 12.404 ± 0.007 Å
• c: 19.869 ± 0.014 Å
• α: 90 ± 0.06°
• β: 92.27 ± 0.07°
• γ: 90 ± 0.06°
• Cell volume: 2936 ± 4 ų
• Cell temperature: 153 ± 5 K
• Ambient diffraction temperature: 153 ± 5 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.167
• Residual factor for significantly intense reflections: 0.0617
• Weighted residual factors for significantly intense reflections: 0.1291
• Weighted residual factors for all reflections included in the refinement: 0.1477
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No