Information card for entry 1576785

Structure parameters

• Formula: C50 H71 Nd S
• Calculated formula: C50 H71 Nd S
• Title of publication: Unexpected dispersion-stabilized tris(terphenylthiolate) complexes, Ln(SAriPr6)3, arising from two-electron reduction by Ln(SAriPr6)2 [AriPr6 = C6H3-2,6-(C6H2-2,6,4-iPr3)2]
• Authors of publication: Luevano, Makayla R.; Stennett, Cary R.; Ma, Eric; Ziller, Joseph W.; Furche, Filipp; Evans, William J.
• Journal of publication: Chemical Science
• Year of publication: 2026
• a: 16.9984 ± 0.0013 Å
• b: 15.6051 ± 0.0012 Å
• c: 18.0517 ± 0.0014 Å
• α: 90°
• β: 113.509 ± 0.001°
• γ: 90°
• Cell volume: 4391 ± 0.6 ų
• Cell temperature: 133.15 K
• Ambient diffraction temperature: 133.15 K
• Number of distinct elements: 4
• 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: 0.0484
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.0852
• Weighted residual factors for all reflections included in the refinement: 0.0931
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No