Information card for entry 4308922

Structure parameters

• Chemical name: hexakis(4-dimethylaminopyridine-iodide-copper(i))
• Formula: C21 H30 Cu3 I3 N6
• Calculated formula: C21 H30 Cu3 I3 N6
• Title of publication: New Structural Motifs, Unusual Quenching of the Emission, and Second Harmonic Generation of Copper(I) Iodide Polymeric or Oligomeric Adducts with Para-Substituted Pyridines or trans-Stilbazoles
• Authors of publication: Elena Cariati; Dominique Roberto; Renato Ugo; Peter C. Ford; Simona Galli; Angelo Sironi
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 4077 - 4085
• a: 14.061 ± 0.006 Å
• b: 11.917 ± 0.005 Å
• c: 17.848 ± 0.007 Å
• α: 90°
• β: 105.58 ± 0.01°
• γ: 90°
• Cell volume: 2881 ± 2 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 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: 0.0859
• Residual factor for significantly intense reflections: 0.0311
• Weighted residual factors for significantly intense reflections: 0.0526
• Weighted residual factors for all reflections included in the refinement: 0.0613
• Goodness-of-fit parameter for all reflections included in the refinement: 0.86
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No