Information card for entry 7105326

Structure parameters

• Formula: C58 H70 Mg N4 O
• Calculated formula: C58 H70 Mg N4 O
• Title of publication: Magnesium(I) reduction of benzophenone and anthracene: first structural characterisation of a magnesium ketyl.
• Authors of publication: Jones, Cameron; McDyre, Lucia; Murphy, Damien M; Stasch, Andreas
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 9
• Pages of publication: 1511 - 1513
• a: 45.398 ± 0.009 Å
• b: 15.262 ± 0.003 Å
• c: 14.927 ± 0.003 Å
• α: 90°
• β: 99.02 ± 0.03°
• γ: 90°
• Cell volume: 10214 ± 4 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• 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: 0.1282
• Residual factor for significantly intense reflections: 0.0723
• Weighted residual factors for significantly intense reflections: 0.1924
• Weighted residual factors for all reflections included in the refinement: 0.2276
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No