Information card for entry 4309325

Structure parameters

• Chemical name: 1-Phenyl-3-pyridin-4-yl-urea silver-hexafluorophosphate complex
• Formula: C24 H22 Ag F6 N6 O2 P
• Calculated formula: C24 H22 Ag F6 N6 O2 P
• SMILES: [Ag]([n]1ccc(NC(=O)Nc2ccccc2)cc1)[n]1ccc(NC(=O)Nc2ccccc2)cc1.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Silver(I) Coordination Polymers Containing Heteroditopic Ureidopyridine Ligands: The Role of Ligand Isomerism, Hydrogen Bonding, and Stacking Interactions
• Authors of publication: Pascal Blondeau; Arie van der Lee; Mihail Barboiu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 5649 - 5653
• a: 9.587 ± 0.001 Å
• b: 11.701 ± 0.001 Å
• c: 12.076 ± 0.001 Å
• α: 109.3 ± 0.01°
• β: 90.75 ± 0.01°
• γ: 89.69 ± 0.01°
• Cell volume: 1278.4 ± 0.2 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0447
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.0759
• Weighted residual factors for all reflections included in the refinement: 0.1186
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No