Information card for entry 7720582

Structure parameters

• Formula: C136 H201.6 O28.8 P4 Tb4
• Calculated formula: C136 H201.6 O28.8 P4 Tb4
• Title of publication: Cubane lanthanoid complexes with tridentate [O, P=O, O] coordination using tris(5-tert-butyl-2-hydroxyphenyl)-phosphine oxide ligands: synthesis, characterisation, and magnetic behaviour
• Authors of publication: Mangundu, Patrick; Ho, Curtis Craig; Mole, Richard; Korb, Marcus; Fuller, Rebecca Olivia
• Journal of publication: Dalton Transactions
• Year of publication: 2026
• a: 15.3975 ± 0.0001 Å
• b: 35.3854 ± 0.0003 Å
• c: 28.9254 ± 0.0002 Å
• α: 90°
• β: 98.787 ± 0.001°
• γ: 90°
• Cell volume: 15574.9 ± 0.2 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 5
• 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: 0.0663
• Residual factor for significantly intense reflections: 0.0572
• Weighted residual factors for significantly intense reflections: 0.1476
• Weighted residual factors for all reflections included in the refinement: 0.1519
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No