Information card for entry 7017381

Structure parameters

• Formula: C39 H57 Mg N3
• Calculated formula: C39 H57 Mg N3
• Title of publication: Magnesium hydrides and the dearomatisation of pyridine and quinoline derivatives.
• Authors of publication: Hill, Michael S.; Kociok-Köhn, Gabriele; Macdougall, Dugald J.; Mahon, Mary F.; Weetman, Catherine
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 46
• Pages of publication: 12500 - 12509
• a: 15.871 ± 0.0002 Å
• b: 24.176 ± 0.0004 Å
• c: 19.349 ± 0.0003 Å
• α: 90°
• β: 98.312 ± 0.001°
• γ: 90°
• Cell volume: 7346.17 ± 0.19 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1506
• Residual factor for significantly intense reflections: 0.0663
• Weighted residual factors for significantly intense reflections: 0.1442
• Weighted residual factors for all reflections included in the refinement: 0.1919
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No