Information card for entry 7030039

Structure parameters

• Formula: C29.5 H43 Cl Mg N2 O
• Calculated formula: C29.5 H43 Cl Mg N2 O
• Title of publication: Lactide polymerization catalyzed by Mg and Zn diketiminate complexes with flexible ligand frameworks.
• Authors of publication: Whitehorne, Todd J. J.; Vabre, Boris; Schaper, Frank
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 17
• Pages of publication: 6339 - 6352
• a: 15.0133 ± 0.0008 Å
• b: 17.0252 ± 0.0009 Å
• c: 22.8695 ± 0.0013 Å
• α: 90°
• β: 102.436 ± 0.002°
• γ: 90°
• Cell volume: 5708.4 ± 0.5 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• 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: 0.0612
• Residual factor for significantly intense reflections: 0.0562
• Weighted residual factors for significantly intense reflections: 0.1547
• Weighted residual factors for all reflections included in the refinement: 0.1593
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No