Information card for entry 1520264

Structure parameters

• Formula: C20 H20 Cu F6 N4 P
• Calculated formula: C20 H20 Cu F6 N4 P
• SMILES: [Cu]([n]1ccccc1)([n]1ccccc1)([n]1ccccc1)[n]1ccccc1.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: tetrakis(Pyridine)-copper(i), hexafluorophosphate
• Authors of publication: Coles, Simon J.; Hursthouse, Michael B.; Sengul, Abdurrahaman; Altin, Safinaz; Kurt, Ozgur
• Journal of publication: Crystal Structure Report Archive
• Year of publication: 2008
• Pages of publication: 385
• a: 12.5009 ± 0.0001 Å
• b: 12.5009 ± 0.0001 Å
• c: 6.9133 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1080.36 ± 0.02 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 82
• Hermann-Mauguin space group symbol: I -4
• Hall space group symbol: I -4
• Residual factor for all reflections: 0.0263
• Residual factor for significantly intense reflections: 0.025
• Weighted residual factors for significantly intense reflections: 0.0636
• Weighted residual factors for all reflections included in the refinement: 0.0643
• Goodness-of-fit parameter for all reflections included in the refinement: 1.116
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No