Information card for entry 4085379

Structure parameters

• Formula: C44 H74 Li2 Mg O5
• Calculated formula: C44 H74 Li2 Mg O5
• Title of publication: Structural Studies of (rac)-BIPHEN Organomagnesiates and Intermediates in the Halogen‒Metal Exchange of 2-Bromopyridine
• Authors of publication: Francos, Javier; Gros, Philippe C.; Kennedy, Alan R.; O’Hara, Charles T.
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 11
• Pages of publication: 2550
• a: 11.315 ± 0.0005 Å
• b: 11.6395 ± 0.0005 Å
• c: 18.4418 ± 0.0008 Å
• α: 88.063 ± 0.003°
• β: 81.313 ± 0.004°
• γ: 69.075 ± 0.004°
• Cell volume: 2242.06 ± 0.18 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0842
• Residual factor for significantly intense reflections: 0.064
• Weighted residual factors for significantly intense reflections: 0.1734
• Weighted residual factors for all reflections included in the refinement: 0.1883
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No