Information card for entry 7111585

Structure parameters

• Formula: C42 H50 N4
• Calculated formula: C42 H50 N4
• SMILES: N(/C(C)=C(C(=N\c1c(cccc1C)C)\C)/C(=C(/Nc1c(cccc1C)C)C)C(=N\c1c(cccc1C)C)\C)c1c(cccc1C)C
• Title of publication: New reaction of β-diketiminatoeuropium complex: sterically induced oxidation‒coupling of β-diketiminato ligands
• Authors of publication: Jiao, Rui; Shen, Xiaodong; Xue, Mingqiang; Zhang, Yong; Yao, Yingming; Shen, Qi
• Journal of publication: Chemical Communications
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 23
• Pages of publication: 4118 - 4120
• a: 15.828 ± 0.002 Å
• b: 22.036 ± 0.003 Å
• c: 22.213 ± 0.003 Å
• α: 90°
• β: 106.104 ± 0.004°
• γ: 90°
• Cell volume: 7443.6 ± 1.7 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 3
• 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: 0.1115
• Residual factor for significantly intense reflections: 0.0795
• Weighted residual factors for significantly intense reflections: 0.1784
• Weighted residual factors for all reflections included in the refinement: 0.1958
• Goodness-of-fit parameter for all reflections included in the refinement: 1.12
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No