Information card for entry 7032701

Structure parameters

• Formula: C34 H32 F6 N4 O2 Zn
• Calculated formula: C34 H32 F6 N4 O2 Zn
• SMILES: [Zn]1234(OC(=CC(=[N]2c2c5[n]1cccc5ccc2)C(F)(F)F)C(C)(C)C)OC(=CC(=[N]4c1cccc2c1[n]3ccc2)C(F)(F)F)C(C)(C)C
• Title of publication: Synthesis and structures of bis-ligated zinc complexes supported by tridentate ketoimines that initiate l-lactide polymerization.
• Authors of publication: Gerling, Kimberly A.; Rezayee, Nomaan M.; Rheingold, Arnold L.; Green, David B.; Fritsch, Joseph M.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 43
• Pages of publication: 16498 - 16508
• a: 13.728 ± 0.002 Å
• b: 15.472 ± 0.002 Å
• c: 15.449 ± 0.002 Å
• α: 90°
• β: 103.124 ± 0.002°
• γ: 90°
• Cell volume: 3195.7 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.0889
• Residual factor for significantly intense reflections: 0.0637
• Weighted residual factors for significantly intense reflections: 0.1469
• Weighted residual factors for all reflections included in the refinement: 0.1605
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No