Information card for entry 4307208

Structure parameters

• Formula: C16 H28 Al N5
• Calculated formula: C16 H28 Al N5
• SMILES: [Al]1([n]2c(C)cc(C)n2CCN1CCn1c(C)cc(C)n1)(C)C
• Title of publication: Aluminum and Zinc Complexes Based on an Amino-Bis(pyrazolyl) Ligand: Synthesis, Structures, and Use in MMA and Lactide Polymerization
• Authors of publication: Bing Lian; Christophe M. Thomas; Osvaldo L. Casagrande; Christian W. Lehmann; Thierry Roisnel; Jean-François Carpentier
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 328 - 340
• a: 13.02 ± 0.0003 Å
• b: 9.5441 ± 0.0002 Å
• c: 14.5474 ± 0.0003 Å
• α: 90°
• β: 94.804 ± 0.001°
• γ: 90°
• Cell volume: 1801.37 ± 0.07 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0587
• Residual factor for significantly intense reflections: 0.0461
• Weighted residual factors for significantly intense reflections: 0.1073
• Weighted residual factors for all reflections included in the refinement: 0.114
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No