Information card for entry 7717051

Structure parameters

• Formula: C6 H18 Br4 Cu2 N2
• Calculated formula: C6 H18 Br4 Cu2 N2
• 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: 7.814 ± 0.0007 Å
• b: 14.6335 ± 0.0013 Å
• c: 12.9812 ± 0.0011 Å
• α: 90°
• β: 93.824 ± 0.003°
• γ: 90°
• Cell volume: 1481 ± 0.2 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0682
• Residual factor for significantly intense reflections: 0.0345
• Weighted residual factors for significantly intense reflections: 0.0656
• Weighted residual factors for all reflections included in the refinement: 0.0762
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No