Information card for entry 7206478

Structure parameters

• Formula: C56.744 H92.435 Cu4 I6 N2
• Calculated formula: C56 H90 Cu4 I6 N2
• Title of publication: Size matters—sometimes. The [CuxIy](y−x)−(NR4)+(y−x) systems
• Authors of publication: Jalilian, Ehsan; Lidin, Sven
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 19
• Pages of publication: 5730
• a: 11.7445 ± 0.0006 Å
• b: 20.9082 ± 0.001 Å
• c: 29.5195 ± 0.0019 Å
• α: 90°
• β: 97.908 ± 0.005°
• γ: 90°
• Cell volume: 7179.8 ± 0.7 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.3622
• Residual factor for significantly intense reflections: 0.0585
• Weighted residual factors for significantly intense reflections: 0.1071
• Weighted residual factors for all reflections included in the refinement: 0.2141
• Goodness-of-fit parameter for significantly intense reflections: 1.02
• Goodness-of-fit parameter for all reflections included in the refinement: 0.81
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No