Information card for entry 7055006

Structure parameters

• Formula: C54 H60 Ce2 O21
• Calculated formula: C54 H60 Ce2 O21
• Title of publication: Rare earth 3-(4′-hydroxyphenyl)propionate complexes
• Authors of publication: Deacon, Glen B.; Junk, Peter C.; Lee, Winnie W.; Forsyth, Maria; Wang, Jun
• Journal of publication: New J. Chem.
• Year of publication: 2015
• Journal volume: 39
• Journal issue: 10
• Pages of publication: 7688
• a: 14.202 ± 0.0011 Å
• b: 15.9564 ± 0.0014 Å
• c: 16.102 ± 0.0011 Å
• α: 116.872 ± 0.005°
• β: 93.433 ± 0.005°
• γ: 92.854 ± 0.005°
• Cell volume: 3236.9 ± 0.5 ų
• Cell temperature: 123 ± 1 K
• Ambient diffraction temperature: 123.15 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1022
• Residual factor for significantly intense reflections: 0.0676
• Weighted residual factors for significantly intense reflections: 0.1755
• Weighted residual factors for all reflections included in the refinement: 0.1891
• Goodness-of-fit parameter for all reflections included in the refinement: 0.986
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No