Information card for entry 7706846

Structure parameters

• Formula: C66 H84 Gd2 O14
• Calculated formula: C66 H84 Gd2 O14
• Title of publication: Dinuclear triple stranded phenyl-spaced 1,3-bis-β-diketonato lanthanide(iii) complexes: synthesis, structures and spectroscopy.
• Authors of publication: Brock, A. J.; Etchells, I. M.; Moore, E. G.; Clegg, J. K.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 14
• Pages of publication: 4874 - 4879
• a: 17.9401 ± 0.0004 Å
• b: 24.2762 ± 0.0004 Å
• c: 16.1921 ± 0.0003 Å
• α: 90°
• β: 105.23 ± 0.002°
• γ: 90°
• Cell volume: 6804.3 ± 0.2 ų
• Cell temperature: 190 K
• Ambient diffraction temperature: 190 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: 0.0651
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.0773
• Weighted residual factors for all reflections included in the refinement: 0.0858
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No