Information card for entry 7709920

Structure parameters

• Formula: C24 H74.34 Nd O10.17 P3 S6
• Calculated formula: C24 H74.34 Nd O10.17 P3 S6
• Title of publication: Identification of Complexes of Nd(III) with Dithiophosphinic Acids Verifying Difference in Complexation between Ln(III) and An(III)
• Authors of publication: Guo, Qiling; Fang, Tuo; Liu, Qian; Zhu, Liyang; Yang, Suliang; Tian, Guoxin
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 16.9097 ± 0.0004 Å
• b: 25.6255 ± 0.0005 Å
• c: 10.9443 ± 0.0003 Å
• α: 90°
• β: 98.04 ± 0.002°
• γ: 90°
• Cell volume: 4695.76 ± 0.19 ų
• Cell temperature: 100.02 ± 0.1 K
• Ambient diffraction temperature: 100.02 ± 0.1 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: 0.048
• Residual factor for significantly intense reflections: 0.0371
• Weighted residual factors for significantly intense reflections: 0.0912
• Weighted residual factors for all reflections included in the refinement: 0.0974
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No