Information card for entry 7032627

Structure parameters

• Formula: C25 H41 N5 O Si2 Zn
• Calculated formula: C25 H41 N5 O Si2 Zn
• SMILES: [Zn]12([n]3n(c(cc3C)C)C(n3[n]1c(cc3C)C)C(O2)c1ccc(cc1)C)N([Si](C)(C)C)[Si](C)(C)C
• Title of publication: Enantiopure N,N,O-scorpionate zinc amide and chloride complexes as efficient initiators for the heteroselective ROP of cyclic esters.
• Authors of publication: Honrado, Manuel; Otero, Antonio; Fernández-Baeza, Juan; Sánchez-Barba, Luis F; Garcés, Andrés; Lara-Sánchez, Agustín; Rodríguez, Ana M
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 45
• Pages of publication: 17090 - 17100
• a: 31.746 ± 0.009 Å
• b: 10.76 ± 0.004 Å
• c: 21.751 ± 0.008 Å
• α: 90°
• β: 124.508 ± 0.011°
• γ: 90°
• Cell volume: 6123 ± 4 ų
• Cell temperature: 230 ± 2 K
• Ambient diffraction temperature: 230 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.172
• Residual factor for significantly intense reflections: 0.0634
• Weighted residual factors for significantly intense reflections: 0.1345
• Weighted residual factors for all reflections included in the refinement: 0.182
• Goodness-of-fit parameter for all reflections included in the refinement: 0.861
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No