Information card for entry 7047807

Structure parameters

• Formula: C44 H44 N6 Zn
• Calculated formula: C44 H44 N6 Zn
• Title of publication: Configurationally flexible zinc complexes as catalysts for rac-lactide polymerisation.
• Authors of publication: Daneshmand, Pargol; Michalsky, Ina; Aguiar, Pedro M.; Schaper, Frank
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 45
• Pages of publication: 16279 - 16291
• a: 11.4428 ± 0.0007 Å
• b: 11.9319 ± 0.0008 Å
• c: 14.2169 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1941.1 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.0391
• Residual factor for significantly intense reflections: 0.0361
• Weighted residual factors for significantly intense reflections: 0.0896
• Weighted residual factors for all reflections included in the refinement: 0.0909
• Goodness-of-fit parameter for all reflections included in the refinement: 1.12
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No