Information card for entry 7717052

Structure parameters

• Formula: C2 H7 Br2 Cu N
• Calculated formula: C2 H7 Br2 Cu N
• Title of publication: Broadband Blue Light Emissions of One-Dimensional Hybrid Cu(I) Halides with Ultrahigh Anti-Water Stability
• Authors of publication: Lin, Na; Li, Yun-Xia; Liu, Yu; Sun, Kai-Qi; Zhang, Hong-Yan; Lei, Xiao-Wu; Chen, Zhi-Wei
• Journal of publication: Dalton Transactions
• Year of publication: 2024
• a: 6.0905 ± 0.0003 Å
• b: 8.8163 ± 0.0005 Å
• c: 11.5467 ± 0.0006 Å
• α: 90°
• β: 97.583 ± 0.002°
• γ: 90°
• Cell volume: 614.59 ± 0.06 ų
• Cell temperature: 273.15 K
• Ambient diffraction temperature: 273.15 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: 0.033
• Residual factor for significantly intense reflections: 0.0236
• Weighted residual factors for significantly intense reflections: 0.0488
• Weighted residual factors for all reflections included in the refinement: 0.0518
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No