Information card for entry 7717271

Structure parameters

• Formula: C50 H88 Al2 Mg N12 O2
• Calculated formula: C50 H88 Al2 Mg N12 O2
• Title of publication: Reactivity of Mg(AlMe4)2 towards neutral tris(pyrazolyl)alkanes
• Authors of publication: Kracht, Felix; Stuhl, Christoph; Maichle-Moessmer, Caecilia; Anwander, Reiner
• Journal of publication: Dalton Transactions
• Year of publication: 2024
• a: 9.7777 ± 0.0012 Å
• b: 12.1692 ± 0.0014 Å
• c: 13.3741 ± 0.0016 Å
• α: 111.897 ± 0.002°
• β: 103.651 ± 0.002°
• γ: 97.092 ± 0.002°
• Cell volume: 1394.8 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.054
• Residual factor for significantly intense reflections: 0.0406
• Weighted residual factors for significantly intense reflections: 0.0961
• Weighted residual factors for all reflections included in the refinement: 0.1045
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No