Information card for entry 7009467

Structure parameters

• Formula: C26 H38 Mg N4
• Calculated formula: C26 H38 Mg N4
• SMILES: [Mg]12([N](C(C)C)=C3C(=CC=CC=C3)N1C(C)C)[N](=C1C(N2C(C)C)=CC=CC=C1)C(C)C
• Title of publication: Synthesis and characterisation of magnesium methyl complexes with monoanionic chelating nitrogen donor ligands and their reaction with dioxygen
• Authors of publication: Bailey, Philip J.; Dick, Caroline M. E.; Fabre, Sylvie; Parsons, Simon
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 10
• Pages of publication: 1655
• a: 9.5281 ± 0.0006 Å
• b: 18.3692 ± 0.0013 Å
• c: 14.2891 ± 0.001 Å
• α: 90°
• β: 93.154 ± 0.007°
• γ: 90°
• Cell volume: 2497.1 ± 0.3 ų
• Cell temperature: 220 ± 2 K
• Ambient diffraction temperature: 220 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0418
• Residual factor for significantly intense reflections: 0.0346
• Weighted residual factors for significantly intense reflections: 0.0888
• Weighted residual factors for all reflections included in the refinement: 0.0931
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No