Information card for entry 7710526

Structure parameters

• Formula: C17 H22 Br N3
• Calculated formula: C17 H22 Br N3
• SMILES: [NH2+]=C(N[C@@H](c1ccccc1)C)N[C@H](C)c1ccccc1.[Br-]
• Title of publication: Asymmetric induction in quadruple-stranded europium(III) helicates and circularly polarized luminescence.
• Authors of publication: Wang, Yunlu; Zhou, Yanyan; Yao, Zhiwei; Huang, Wenru; Gao, Ting; Yan, Pengfei; Li, Hongfeng
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2022
• Journal volume: 51
• Journal issue: 29
• Pages of publication: 10973 - 10982
• a: 25.435 ± 0.002 Å
• b: 25.435 ± 0.002 Å
• c: 7.2225 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 4046.5 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 146
• Hermann-Mauguin space group symbol: R 3 :H
• Hall space group symbol: R 3
• Residual factor for all reflections: 0.0459
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.0685
• Weighted residual factors for all reflections included in the refinement: 0.0737
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No