Information card for entry 7128366

Structure parameters

• Formula: C73 H98 Al2 N6
• Calculated formula: C73 H97 Al2 N6
• Title of publication: Organometallo-macrocycle assembled through dialumane-mediated C-H activation of pyridines.
• Authors of publication: Chen, Weixing; Liu, Li; Zhao, Yanxia; Xue, Yujie; Xu, Wenhua; Li, Nan; Wu, Biao; Yang, Xiao-Juan
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 51
• Pages of publication: 6268 - 6271
• a: 12.469 ± 0.008 Å
• b: 13.297 ± 0.008 Å
• c: 19.852 ± 0.013 Å
• α: 90°
• β: 97.499 ± 0.019°
• γ: 90°
• Cell volume: 3263 ± 4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.1177
• Residual factor for significantly intense reflections: 0.0988
• Weighted residual factors for significantly intense reflections: 0.2331
• Weighted residual factors for all reflections included in the refinement: 0.247
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No