Information card for entry 7713915

Structure parameters

• Formula: C44 H54 Cl4 Cu2 N12 O2
• Calculated formula: C44 H54 Cl4 Cu2 N12 O2
• Title of publication: Polymeric copper(I)–NHC complexes with bulky bidentate (N^C) ligands: synthesis and solid-state luminescence
• Authors of publication: Arruri, Sathyanarayana; Réveret, François; Jouffret, Laurent; Boyer, Damien; Chadeyron, Genevieve; Cisnetti, Federico
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 10.2745 ± 0.0007 Å
• b: 11.2131 ± 0.0007 Å
• c: 11.3294 ± 0.0008 Å
• α: 91.902 ± 0.004°
• β: 93.379 ± 0.004°
• γ: 113.401 ± 0.003°
• Cell volume: 1193.52 ± 0.14 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.1037
• Residual factor for significantly intense reflections: 0.0616
• Weighted residual factors for significantly intense reflections: 0.1604
• Weighted residual factors for all reflections included in the refinement: 0.1885
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No