Information card for entry 2016005

Structure parameters

• Common name: Tetraphenylphosphonium copper(I) dicyanamide
• Chemical name: Poly[tetraphenylphosphonium copper(I)-di-μ~2~-dicyanamido]
• Formula: C28 H20 Cu N6 P
• Calculated formula: C28 H20 Cu N6 P
• Title of publication: Poly[tetraphenylphosphonium copper(I)-di-μ~2~-dicyanamido]
• Authors of publication: Schlueter, John A.; Geiser, Urs
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 6
• Pages of publication: m235 - m237
• a: 12.7929 ± 0.0012 Å
• b: 13.4006 ± 0.0012 Å
• c: 14.4847 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2483.1 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0559
• Residual factor for significantly intense reflections: 0.0388
• Weighted residual factors for significantly intense reflections: 0.0772
• Weighted residual factors for all reflections included in the refinement: 0.0827
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes