Information card for entry 7048084

Structure parameters

• Formula: C34 H40 O3
• Calculated formula: C34 H40 O3
• Title of publication: Lanthanoid complexes supported by retro-Claisen condensation products of β-triketonates.
• Authors of publication: Abad Galán, Laura; Sobolev, Alexandre N.; Zysman-Colman, Eli; Ogden, Mark I.; Massi, Massimiliano
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 48
• Pages of publication: 17469 - 17478
• a: 12.7501 ± 0.0003 Å
• b: 10.0565 ± 0.0002 Å
• c: 22.7503 ± 0.0005 Å
• α: 90°
• β: 97.672 ± 0.002°
• γ: 90°
• Cell volume: 2890.96 ± 0.11 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0642
• Residual factor for significantly intense reflections: 0.0438
• Weighted residual factors for significantly intense reflections: 0.1048
• Weighted residual factors for all reflections included in the refinement: 0.1183
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No