Information card for entry 4067294

Structure parameters

• Chemical name: (N,N,N'N'-tetramethylethylenediamine)-bis(s-butyl)-zinc
• Formula: C14 H34 N2 Zn
• Calculated formula: C14 H34 N2 Zn
• SMILES: C[C@H]([Zn]1([C@@H](C)CC)[N](CC[N]1(C)C)(C)C)CC.C[C@@H]([Zn]1([C@H](C)CC)[N](CC[N]1(C)C)(C)C)CC
• Title of publication: Toward Total Spontaneous Resolution ofsec-Butylzinc Complexes
• Authors of publication: Lennartson, Anders; Hedström, Anna; Håkansson, Mikael
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 1
• Pages of publication: 177
• a: 16.865 ± 0.005 Å
• b: 9.1648 ± 0.0016 Å
• c: 13.088 ± 0.003 Å
• α: 90°
• β: 124.06 ± 0.02°
• γ: 90°
• Cell volume: 1675.9 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0236
• Residual factor for significantly intense reflections: 0.0229
• Weighted residual factors for significantly intense reflections: 0.0589
• Weighted residual factors for all reflections included in the refinement: 0.0591
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No