Information card for entry 4067292

Structure parameters

• Chemical name: bis(2-methylpyridine)-bis(s-butyl)-zinc
• Formula: C20 H32 N2 Zn
• Calculated formula: C20 H32 N2 Zn
• SMILES: C[C@@H](CC)[Zn]([n]1c(cccc1)C)([C@@H](C)CC)[n]1c(cccc1)C.C[C@H](CC)[Zn]([n]1c(cccc1)C)([C@H](C)CC)[n]1c(cccc1)C
• 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: 15.794 ± 0.004 Å
• b: 7.8917 ± 0.0013 Å
• c: 17.541 ± 0.004 Å
• α: 90°
• β: 115.96 ± 0.007°
• γ: 90°
• Cell volume: 1965.7 ± 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: 0.0321
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.0792
• Weighted residual factors for all reflections included in the refinement: 0.0796
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No