Information card for entry 7014730

Structure parameters

• Formula: C20 H52 N4 O4 Zn4
• Calculated formula: C20 H52 N4 O4 Zn4
• SMILES: [Zn]12([O]3[Zn]4([O]5[Zn]([O]1[N]([Zn]([O]2[N]4(CC)CC)([N]5(CC)CC)C)(CC)CC)([N]3(CC)CC)C)C)C
• Title of publication: Organozinc hydroxylamides: on the bulk-dependent interplay of nuclearity, structure and dynamics.
• Authors of publication: Ullrich, Matthias; Berger, Raphael J. F.; Jana, Surajit; Pape, Tania; Fröhlich, Roland; Mitzel, Norbert W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 5
• Pages of publication: 1144 - 1157
• a: 9.171 ± 0.001 Å
• b: 17.464 ± 0.001 Å
• c: 19.446 ± 0.001 Å
• α: 90°
• β: 102.82 ± 0.01°
• γ: 90°
• Cell volume: 3036.9 ± 0.4 ų
• Cell temperature: 198 ± 2 K
• Ambient diffraction temperature: 198 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.038
• Residual factor for significantly intense reflections: 0.0275
• Weighted residual factors for significantly intense reflections: 0.0602
• Weighted residual factors for all reflections included in the refinement: 0.0635
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No