Information card for entry 7037131

Structure parameters

• Formula: C34 H38 Cl2 Cu F6 N6 P3
• Calculated formula: C34 H38 Cl2 Cu F6 N6 P3
• Title of publication: Tris(pyrazolyl)phosphines with copper(i): from monomers to polymers.
• Authors of publication: Tazelaar, Cornelis G. J.; Nicolas, Emmanuel; van Dijk, Tom; Broere, Daniël L J; Cardol, Mitchel; Lutz, Martin; Gudat, Dietrich; Slootweg, J. Chris; Lammertsma, Koop
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 5
• Pages of publication: 2237 - 2249
• a: 14.3558 ± 0.0001 Å
• b: 31.5939 ± 0.0002 Å
• c: 16.7621 ± 0.0001 Å
• α: 90°
• β: 90.6316 ± 0.0002°
• γ: 90°
• Cell volume: 7602.08 ± 0.08 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• 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: 0.0729
• Residual factor for significantly intense reflections: 0.0481
• Weighted residual factors for significantly intense reflections: 0.1134
• Weighted residual factors for all reflections included in the refinement: 0.125
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No