Information card for entry 7716834

Structure parameters

• Formula: C39 H45 Al Cl2 N2
• Calculated formula: C39 H45 Al Cl2 N2
• Title of publication: Effects of a Central Element on Photoluminescence Properties of β-Diketiminate Complexes Composed of the Group 13 Elements
• Authors of publication: Ito, Shunichiro; Tanaka, Kazuo; Chujo, Yoshiki
• Journal of publication: Dalton Transactions
• Year of publication: 2024
• a: 8.878 ± 0.003 Å
• b: 16.177 ± 0.002 Å
• c: 24.527 ± 0.002 Å
• α: 90°
• β: 91.897 ± 0.016°
• γ: 90°
• Cell volume: 3520.6 ± 1.3 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 2 K
• Number of distinct elements: 5
• 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: 0.1302
• Residual factor for significantly intense reflections: 0.1081
• Weighted residual factors for significantly intense reflections: 0.2582
• Weighted residual factors for all reflections included in the refinement: 0.2748
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No