Information card for entry 7022477

Structure parameters

• Formula: C50 H84 K2 N2 O10
• Calculated formula: C50 H84 K2 N2 O10
• Title of publication: Alkali aminoether-phenolate complexes: synthesis, structural characterization and evidence for an activated monomer ROP mechanism.
• Authors of publication: Roşca, Sorin-Claudiu; Roşca, Dragoş-Adrian; Dorcet, Vincent; Kozak, Christopher M.; Kerton, Francesca M.; Carpentier, Jean-François; Sarazin, Yann
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 25
• Pages of publication: 9361 - 9375
• a: 17.3807 ± 0.0005 Å
• b: 17.0158 ± 0.0005 Å
• c: 20.0753 ± 0.0005 Å
• α: 90°
• β: 111.724 ± 0.001°
• γ: 90°
• Cell volume: 5515.5 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• 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: 0.0729
• Residual factor for significantly intense reflections: 0.0427
• Weighted residual factors for significantly intense reflections: 0.0943
• Weighted residual factors for all reflections included in the refinement: 0.1077
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No