Information card for entry 7106333

Structure parameters

• Formula: C32 H26 Ag N7 O5
• Calculated formula: C32 H26 Ag N7 O5
• SMILES: [Ag]([n]1c2cccc(NC(=O)Nc3ccccc3)c2ccc1)[n]1c2cccc(NC(=O)Nc3ccccc3)c2ccc1.N(=O)(=O)[O-]
• Title of publication: Polymorphs from supramolecular gels: four crystal forms of the same silver(I) supergelator crystallized directly from its gels
• Authors of publication: Dario Braga; Simone d'Agostino; Eros D'Amen; Fabrizia Grepioni
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 5154
• a: 7.687 ± 0.0003 Å
• b: 10.5157 ± 0.0004 Å
• c: 18.9647 ± 0.0008 Å
• α: 100.092 ± 0.003°
• β: 101.64 ± 0.003°
• γ: 99.17 ± 0.003°
• Cell volume: 1447.79 ± 0.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1022
• Residual factor for significantly intense reflections: 0.0375
• Weighted residual factors for significantly intense reflections: 0.0436
• Weighted residual factors for all reflections included in the refinement: 0.0485
• Goodness-of-fit parameter for all reflections included in the refinement: 0.851
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No