Information card for entry 7030031

Structure parameters

• Formula: C48 H55 N3 Si2 Zn
• Calculated formula: C48 H55 N3 Si2 Zn
• SMILES: [Zn]1(N(C(=CC(=[N]1Cc1c2ccccc2cc2ccccc12)C)C)Cc1c2ccccc2cc2ccccc12)N([Si](C)(C)C)[Si](C)(C)C.Cc1ccccc1
• 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: 13.0063 ± 0.0003 Å
• b: 15.7472 ± 0.0004 Å
• c: 20.9693 ± 0.0005 Å
• α: 84.7981 ± 0.0011°
• β: 86.8527 ± 0.0012°
• γ: 83.0374 ± 0.001°
• Cell volume: 4241.36 ± 0.18 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0449
• Residual factor for significantly intense reflections: 0.0404
• Weighted residual factors for significantly intense reflections: 0.1144
• Weighted residual factors for all reflections included in the refinement: 0.1181
• Goodness-of-fit parameter for all reflections included in the refinement: 0.913
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No