Information card for entry 7048238

Structure parameters

• Formula: C10 H8 Cu2 I8 N6
• Calculated formula: C10 H8 Cu2 I8 N6
• Title of publication: An unusual cuprous iodide polymer incorporating I^-, I₂ and I₃^- structural units.
• Authors of publication: Hu, Jun; Zhou, Jian; Cao, Shumei
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 48
• Pages of publication: 17216 - 17220
• a: 15.105 ± 0.007 Å
• b: 9.426 ± 0.002 Å
• c: 17.316 ± 0.008 Å
• α: 90°
• β: 94.93 ± 0.05°
• γ: 90°
• Cell volume: 2456.3 ± 1.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0718
• Residual factor for significantly intense reflections: 0.0374
• Weighted residual factors for significantly intense reflections: 0.0693
• Weighted residual factors for all reflections included in the refinement: 0.0803
• Goodness-of-fit parameter for all reflections included in the refinement: 1.008
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No