Information card for entry 2211758

Structure parameters

• Chemical name: Diisopropyl(N,N,N',N'-tetramethylethylenediamine)zinc(II)
• Formula: C12 H30 N2 Zn
• Calculated formula: C12 H30 N2 Zn
• SMILES: CC([Zn]1(C(C)C)[N](CC[N]1(C)C)(C)C)C
• Title of publication: Diisopropyl(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine)zinc(II), the first crystal structure of a diisopropylzinc complex
• Authors of publication: Lennartson, Anders; Hedström, Anna; Håkansson, Mikael
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 1
• Pages of publication: m123 - m125
• a: 14.37 ± 0.004 Å
• b: 8.5935 ± 0.0016 Å
• c: 12.684 ± 0.003 Å
• α: 90°
• β: 104.928 ± 0.008°
• γ: 90°
• Cell volume: 1513.5 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• 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: 0.0256
• Residual factor for significantly intense reflections: 0.0242
• Weighted residual factors for significantly intense reflections: 0.0642
• Weighted residual factors for all reflections included in the refinement: 0.0646
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes