Information card for entry 2224048

Structure parameters

• Chemical name: Carbonyl[tris(3,5-diphenylpyrazol-1-yl-κ<i>N</i>^2^)methane]copper(I) hexafluoridophosphate‒dichloromethane‒diethyl ether (4/3/1)
• Formula: C48.75 H38 Cl1.5 Cu F6 N6 O1.25 P
• Calculated formula: C48.75 H38 Cl1.5 Cu F6 N6 O1.25 P
• Title of publication: Carbonyl[tris(3,5-diphenylpyrazol-1-yl-κ<i>N</i>^2^)methane]copper(I) hexafluoridophosphate‒dichloromethane‒diethyl ether (4/3/1)
• Authors of publication: Miller, Katie E.; Schopp, Lauren M.; Nesseth, Kelly N.; Moore, Curtis; Rheingold, Arnold L.; Daley, Christopher J. A.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 11
• Pages of publication: m1354 - m1355
• a: 19.891 ± 0.003 Å
• b: 13.772 ± 0.002 Å
• c: 16.091 ± 0.003 Å
• α: 90°
• β: 93.847 ± 0.002°
• γ: 90°
• Cell volume: 4398 ± 1.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• 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: 0.0656
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.105
• Weighted residual factors for all reflections included in the refinement: 0.1159
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes