Information card for entry 4072113

Structure parameters

• Common name: 1,4-(DIPP-nacnac-Zn(N(SiMe3)2)2-C6H4
• Formula: C58 H94 N6 Si4 Zn2
• Calculated formula: C58 H94 N6 Si4 Zn2
• SMILES: [Zn]1(N(C(=CC(=[N]1c1c(cccc1C(C)C)C(C)C)C)C)c1ccc(N2[Zn]([N](=C(C=C2C)C)c2c(cccc2C(C)C)C(C)C)N([Si](C)(C)C)[Si](C)(C)C)cc1)N([Si](C)(C)C)[Si](C)(C)C.c1ccccc1
• Title of publication: Bimetallic Calcium and Zinc Complexes with Bridged β-Diketiminate Ligands: Investigations on Epoxide/CO2Copolymerization
• Authors of publication: Piesik, Dirk F.-J.; Range, Sven; Harder, Sjoerd
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 23
• Pages of publication: 6178
• a: 18.469 ± 0.003 Å
• b: 21.213 ± 0.004 Å
• c: 19.522 ± 0.004 Å
• α: 90°
• β: 117.927 ± 0.01°
• γ: 90°
• Cell volume: 6758 ± 2 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 5
• 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: 0.0616
• Residual factor for significantly intense reflections: 0.0397
• Weighted residual factors for significantly intense reflections: 0.0977
• Weighted residual factors for all reflections included in the refinement: 0.1038
• Goodness-of-fit parameter for all reflections included in the refinement: 0.991
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No