Information card for entry 7042618

Structure parameters

• Formula: C118 H170 Al2 N4 O15
• Calculated formula: C118 H154 Al2 N4 O15
• Title of publication: Aluminum complexes derived from a hexadentate salen-type Schiff base: synthesis, structure, and catalysis for cyclic carbonate synthesis
• Authors of publication: Xu, Ya; Yuan, Dan; Wang, Yaorong; Yao, Yingming
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 23.47 ± 0.002 Å
• b: 14.8888 ± 0.0011 Å
• c: 33.879 ± 0.003 Å
• α: 90°
• β: 103.819 ± 0.008°
• γ: 90°
• Cell volume: 11496 ± 1.7 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 5
• 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: 0.1816
• Residual factor for significantly intense reflections: 0.1189
• Weighted residual factors for significantly intense reflections: 0.3314
• Weighted residual factors for all reflections included in the refinement: 0.375
• Goodness-of-fit parameter for all reflections included in the refinement: 1.184
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No