Information card for entry 4079613

Structure parameters

• Formula: C28 H50 Li2 Mg N4
• Calculated formula: C28 H50 Li2 Mg N4
• SMILES: [Mg]123[C]4(=CC=CC=C4)[Li]4([N](CC[N]4(C)C)(C)C)[CH2]2CC[CH2]3[Li]2([N](CC[N]2(C)C)(C)C)[C]12=CC=CC=C2
• Title of publication: Synthesis, Crystal Structures, and Solution Behavior of Organomagnesium Derivatives of Alkane-1,4-diide as Well as -1,5-diide
• Authors of publication: Fischer, Reinald; Suxdorf, Regina; Görls, Helmar; Westerhausen, Matthias
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 21
• Pages of publication: 7579
• a: 11.1834 ± 0.0002 Å
• b: 9.7428 ± 0.0001 Å
• c: 14.183 ± 0.0003 Å
• α: 90°
• β: 93.891 ± 0.001°
• γ: 90°
• Cell volume: 1541.78 ± 0.05 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0379
• Residual factor for significantly intense reflections: 0.0358
• Weighted residual factors for significantly intense reflections: 0.0828
• Weighted residual factors for all reflections included in the refinement: 0.0849
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No