Information card for entry 7217320

Structure parameters

• Formula: C6 H8 Cu2 I2 N2
• Calculated formula: C6 H8 Cu2 I2 N2
• Title of publication: Polymeric one- and two-dimensional copper(i) iodide complexes showing photoluminescence tunable by azaaromatic ligands
• Authors of publication: Kitada, Nobuo; Ishida, Takayuki
• Journal of publication: CrystEngComm
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 34
• Pages of publication: 8035
• a: 14.8105 ± 0.0006 Å
• b: 10.1034 ± 0.0006 Å
• c: 6.8817 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1029.75 ± 0.09 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• Space group number: 54
• Hermann-Mauguin space group symbol: P c c a
• Hall space group symbol: -P 2a 2ac
• Residual factor for significantly intense reflections: 0.0307
• Weighted residual factors for all reflections included in the refinement: 0.0549
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No