Information card for entry 2207308

Structure parameters

• Chemical name: μ-1,2-Ethanediylbis(diphenylphosphine)-κ^2^P:P'-bis{acetato[1,2- ethanediylbis(diphenylphosphine)-κ^2^P,P']copper(I)} diethyl ether disolvate
• Formula: C90 H98 Cu2 O6 P6
• Calculated formula: C90 H98 Cu2 O6 P6
• SMILES: C1C[P](c2ccccc2)(c2ccccc2)[Cu]([P]1(c1ccccc1)c1ccccc1)([P](CC[P](c1ccccc1)(c1ccccc1)[Cu]1([P](CC[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)OC(=O)C)(c1ccccc1)c1ccccc1)OC(=O)C.CCOCC.CCOCC
• Title of publication: μ-1,2-Ethanediylbis(diphenylphosphine)-κ^2^<i>P</i>:<i>P</i>'-bis{acetato[1,2-ethanediylbis(diphenylphosphine)-κ^2^<i>P</i>,<i>P</i>']copper(I)} diethyl ether disolvate
• Authors of publication: Morawitz, Thorsten; Lerner, Hans-Wolfram; Bru Roig, Miriam; Bolte, Michael
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 11
• Pages of publication: m2201 - m2203
• a: 12.652 ± 0.0009 Å
• b: 12.876 ± 0.0009 Å
• c: 14.2907 ± 0.0011 Å
• α: 85.069 ± 0.006°
• β: 83.287 ± 0.006°
• γ: 61.629 ± 0.005°
• Cell volume: 2033.2 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1244
• Residual factor for significantly intense reflections: 0.1186
• Weighted residual factors for significantly intense reflections: 0.2879
• Weighted residual factors for all reflections included in the refinement: 0.2911
• Goodness-of-fit parameter for all reflections included in the refinement: 1.133
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes