Information card for entry 7109282

Structure parameters

• Formula: C11 H14 Ag3 N9 O9
• Calculated formula: C11 H14 Ag3 N9 O9
• Title of publication: Metallomacrocycles as anion receptors: combining hydrogen bonding and ion pair based hosts formed from Ag(I) salts and flexible bis- and tris-pyrimidine ligands
• Authors of publication: Andres Tasada; Francisca M. Alberti; Antonio Bauza; Miquel Barcelo-Oliver; Angel Garcia-Raso; Juan J. Fiol; Elies Molins; Amparo Caubet; Antonio Frontera
• Journal of publication: Chem.Commun.
• Year of publication: 2013
• Journal volume: 49
• Pages of publication: 4944
• a: 8.368 ± 0.003 Å
• b: 7.7 ± 0.001 Å
• c: 29.646 ± 0.017 Å
• α: 90°
• β: 94.91 ± 0.04°
• γ: 90°
• Cell volume: 1903.2 ± 1.3 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0568
• Residual factor for significantly intense reflections: 0.0524
• Weighted residual factors for significantly intense reflections: 0.1447
• Weighted residual factors for all reflections included in the refinement: 0.148
• Goodness-of-fit parameter for all reflections included in the refinement: 1.212
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No