Information card for entry 7037132

Structure parameters

• Formula: C18 H18 Cu F6 N12 P3
• Calculated formula: C18 H18 Cu F6 N12 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: 19.5288 ± 0.0014 Å
• b: 19.5288 ± 0.0014 Å
• c: 18.0311 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 5955.3 ± 0.8 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 6
• Space group number: 159
• Hermann-Mauguin space group symbol: P 3 1 c
• Hall space group symbol: P 3 -2c
• Residual factor for all reflections: 0.0377
• Residual factor for significantly intense reflections: 0.0317
• Weighted residual factors for significantly intense reflections: 0.0799
• Weighted residual factors for all reflections included in the refinement: 0.083
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No