Information card for entry 7104115

Structure parameters

• Formula: C24 H36 N4 Zn2
• Calculated formula: C24 H36 N4 Zn2
• SMILES: C(C)(C)(C)[Zn]12[n]3(cccc3C3=[N]2CCC3)[Zn]2(C(C)(C)C)[n]31cccc3C1=[N]2CCC1
• Title of publication: Oxygenation of alkylzinc complexes with pyrrolylketiminate ligand: access to alkylperoxide versus oxo-encapsulated complexes.
• Authors of publication: Lewiński, Janusz; Suwała, Karolina; Kaczorowski, Tomasz; Gałezowski, Michał; Gryko, Daniel T; Justyniak, Iwona; Lipkowski, Janusz
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2008
• Journal volume: 34
• Journal issue: 2
• Pages of publication: 215 - 217
• a: 8.3637 ± 0.0002 Å
• b: 8.7342 ± 0.0003 Å
• c: 9.4312 ± 0.0003 Å
• α: 105.136 ± 0.0011°
• β: 104.473 ± 0.002°
• γ: 104.829 ± 0.002°
• Cell volume: 604.73 ± 0.03 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0276
• Residual factor for significantly intense reflections: 0.0254
• Weighted residual factors for significantly intense reflections: 0.0554
• Weighted residual factors for all reflections included in the refinement: 0.0563
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No