Information card for entry 7718899

Structure parameters

• Formula: C70 H108 Cl10 Dy6 N6 O28
• Calculated formula: C54 H68 Cl8 Dy6 N6 O26
• Title of publication: Trinuclear rare earth pyridyl-β-diketonate complexes: developing new methods towards finding lost toroidal spin states.
• Authors of publication: Mangundu, Patrick; Tanner, Kate E.; Bloomfield, Andrew; Barnard, Peter J.; White, Keith F.; Ho, Curtis C.; Yepuri, Nageshwar R.; Mole, Richard A.; Fuller, Rebecca O.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 26
• Pages of publication: 10455 - 10466
• a: 15.6133 ± 0.0004 Å
• b: 18.1248 ± 0.0006 Å
• c: 18.1431 ± 0.0007 Å
• α: 85.924 ± 0.003°
• β: 89.925 ± 0.002°
• γ: 74.263 ± 0.003°
• Cell volume: 4928.5 ± 0.3 ų
• Cell temperature: 150.1 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0763
• Residual factor for significantly intense reflections: 0.0584
• Weighted residual factors for significantly intense reflections: 0.1421
• Weighted residual factors for all reflections included in the refinement: 0.15
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No