Information card for entry 1546126

Structure parameters

• Formula: C47 H54 Cl12 Mg2 N6 O2
• Calculated formula: C47 H54 Cl12 Mg2 N6 O2
• Title of publication: Divergent [{ONNN}Mg-Cl] complexes in the highly active and living lactide polymerization
• Authors of publication: Rosen, Tomer; Goldberg, I.; Navarra, Wanda; Venditto, Vincenzo; Kol, Moshe
• Journal of publication: Chem. Sci.
• Year of publication: 2017
• a: 27.298 ± 0.0018 Å
• b: 14.9001 ± 0.0012 Å
• c: 16.8775 ± 0.001 Å
• α: 90°
• β: 124.63 ± 0.002°
• γ: 90°
• Cell volume: 5648.6 ± 0.7 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0702
• Residual factor for significantly intense reflections: 0.0567
• Weighted residual factors for significantly intense reflections: 0.1488
• Weighted residual factors for all reflections included in the refinement: 0.1604
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No