Information card for entry 7014886

Structure parameters

• Formula: C33.5 H54.5 N4 O4 Zn
• Calculated formula: C33.5 H54 N4 O4 Zn
• Title of publication: Synthesis and characterisation of trigonal C(2)-chiral di- and tetra-substituted bis(oxazoline) alkyl zinc complexes and their reactivity towards protic reagents.
• Authors of publication: Le Roux, Erwan; Merle, Nicolas; Törnroos, Karl W
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 8
• Pages of publication: 1768 - 1777
• a: 17.0744 ± 0.0009 Å
• b: 10.7322 ± 0.0006 Å
• c: 19.3548 ± 0.001 Å
• α: 90°
• β: 107.654 ± 0.001°
• γ: 90°
• Cell volume: 3379.7 ± 0.3 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0206
• Residual factor for significantly intense reflections: 0.0203
• Weighted residual factors for significantly intense reflections: 0.0548
• Weighted residual factors for all reflections included in the refinement: 0.055
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No