Information card for entry 4083397

Structure parameters

• Chemical name: 2,6-diisopropyl-N-(1-phenylvinyl)benzenamino magnesium bromine
• Formula: C28 H40 Br Mg N O2
• Calculated formula: C28 H40 Br Mg N O2
• SMILES: [Mg](Br)(N(C(=C)c1ccccc1)c1c(cccc1C(C)C)C(C)C)([O]1CCCC1)[O]1CCCC1
• Title of publication: (η3-Azaallyl)zirconium Chlorides: Synthesis, Characterization, and Ethylene (Co-)polymerization Activity
• Authors of publication: Yuan, Shifang; Bai, Shengdi; Liu, Diansheng; Sun, Wen-Hua
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 9
• Pages of publication: 2132
• a: 8.413 ± 0.004 Å
• b: 17.455 ± 0.009 Å
• c: 9.899 ± 0.005 Å
• α: 90°
• β: 108.337 ± 0.006°
• γ: 90°
• Cell volume: 1379.8 ± 1.2 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0775
• Residual factor for significantly intense reflections: 0.0577
• Weighted residual factors for significantly intense reflections: 0.1341
• Weighted residual factors for all reflections included in the refinement: 0.1617
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No