Information card for entry 4511271

Structure parameters

• Formula: C33.25 H40.5 Ag2 Cl0.5 F12 N10 O0.25 P2
• Calculated formula: C33.25 H40.5 Ag2 Cl0.5 F12 N10 O0.25 P2
• Title of publication: Metal Supramolecular Frameworks with Silver and Ditopic Bis(pyrazolyl)methane Ligands: Effect of the Anions and Ligand Substitution
• Authors of publication: Durá, Gema; Carrión, M. Carmen; Jalón, Félix A.; Rodríguez, Ana M.; Manzano, Blanca R.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2014
• Journal volume: 14
• Journal issue: 7
• Pages of publication: 3510
• a: 14.516 ± 0.001 Å
• b: 14.916 ± 0.0011 Å
• c: 23.296 ± 0.0016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5044.1 ± 0.6 ų
• Cell temperature: 230 ± 2 K
• Ambient diffraction temperature: 230 ± 2 K
• Number of distinct elements: 8
• 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: 0.1509
• Residual factor for significantly intense reflections: 0.0819
• Weighted residual factors for significantly intense reflections: 0.2013
• Weighted residual factors for all reflections included in the refinement: 0.2482
• Goodness-of-fit parameter for all reflections included in the refinement: 0.959
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No