Information card for entry 2225942

Structure parameters

• Chemical name: Bis[<i>cis</i>-bis(diphenylphosphino)ethene]copper(I) dichloridocuprate(I)
• Formula: C52 H44 Cl2 Cu2 P4
• Calculated formula: C52 H44 Cl2 Cu2 P4
• SMILES: [Cu]12([P](C=C[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)[P](C=C[P]2(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.[Cu](Cl)Cl
• Title of publication: Bis[<i>cis</i>-bis(diphenylphosphino)ethene]copper(I) dichloridocuprate(I)
• Authors of publication: Healy, Peter C.; McMurtrie, John C.; Bouzaid, Jocelyne
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 5
• Pages of publication: m493 - m494
• a: 15.3109 ± 0.0009 Å
• b: 16.1519 ± 0.0011 Å
• c: 18.6419 ± 0.0008 Å
• α: 90°
• β: 95.95 ± 0.004°
• γ: 90°
• Cell volume: 4585.3 ± 0.5 ų
• Cell temperature: 223 K
• Ambient diffraction temperature: 223 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0653
• Residual factor for significantly intense reflections: 0.0523
• Weighted residual factors for significantly intense reflections: 0.1351
• Weighted residual factors for all reflections included in the refinement: 0.1404
• Goodness-of-fit parameter for all reflections included in the refinement: 1.096
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes