Information card for entry 7713884

Structure parameters

• Formula: C53 H73 Al Mg N6 O2
• Calculated formula: C53 H73 Al Mg N6 O2
• Title of publication: Atom economic access to cationic magnesium complexes
• Authors of publication: Brouillet, Etienne Volcan; Brown, Scott; Kennedy, Alan; Rae, Annabel; Walton, Heather; Robertson, Stuart Duncan
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 38.2698 ± 0.0012 Å
• b: 9.7287 ± 0.0003 Å
• c: 27.2433 ± 0.0008 Å
• α: 90°
• β: 92.726 ± 0.003°
• γ: 90°
• Cell volume: 10131.6 ± 0.5 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• 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: 0.0748
• Residual factor for significantly intense reflections: 0.0523
• Weighted residual factors for significantly intense reflections: 0.1326
• Weighted residual factors for all reflections included in the refinement: 0.1603
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No