Information card for entry 7720311

Structure parameters

• Chemical name: Imidazolium iodocuprate
• Formula: C9 H15 Cu3 I6 N6
• Calculated formula: C9 H15 Cu3 I6 N6
• Title of publication: Structural and luminescence properties of acetamidinium- and imidazolium-based copper halides.
• Authors of publication: Petrov, Andrey A.; Chen, Luyi; Li, Mingming; Fateev, Sergey A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2026
• Journal volume: 55
• Journal issue: 8
• Pages of publication: 3422 - 3427
• a: 8.5159 ± 0.0007 Å
• b: 14.1096 ± 0.0011 Å
• c: 10.9304 ± 0.0008 Å
• α: 90°
• β: 106.81 ± 0.003°
• γ: 90°
• Cell volume: 1257.23 ± 0.17 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 5
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0599
• Residual factor for significantly intense reflections: 0.0354
• Weighted residual factors for significantly intense reflections: 0.0639
• Weighted residual factors for all reflections included in the refinement: 0.0721
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No