Information card for entry 7234285

Structure parameters

• Formula: C28 H28 Cu4 I4 N8 O0
• Calculated formula: C28 H28 Cu4 I4 N8
• Title of publication: Copper(i)-iodide based coordination polymers: bifunctional properties related to thermochromism and PMMA-doped polymer film materials
• Authors of publication: Yang Song; Ruiqing Fan; Ping Wang; Xinming Wang; Song Gao; Xi Du; Yulin Yang; Tianzhu Luan
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2015
• Journal volume: 3
• Pages of publication: 6249 - 6259
• a: 8.9396 ± 0.0012 Å
• b: 14.0865 ± 0.0019 Å
• c: 14.727 ± 0.002 Å
• α: 92.344 ± 0.002°
• β: 97.653 ± 0.002°
• γ: 90.604 ± 0.002°
• Cell volume: 1836.2 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0407
• Residual factor for significantly intense reflections: 0.0299
• Weighted residual factors for significantly intense reflections: 0.0837
• Weighted residual factors for all reflections included in the refinement: 0.0906
• Goodness-of-fit parameter for all reflections included in the refinement: 0.91
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No