Information card for entry 7106330

Structure parameters

• Formula: C32 H26 Ag N7 O5
• Calculated formula: C32 H26 Ag N7 O5
• SMILES: [Ag]([n]1c2cccc(NC(=O)Nc3ccccc3)c2ccc1)[n]1c2c(c(NC(=O)Nc3ccccc3)ccc2)ccc1.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: 14.9972 ± 0.0007 Å
• b: 9.1664 ± 0.0005 Å
• c: 21.561 ± 0.0013 Å
• α: 90°
• β: 101.587 ± 0.005°
• γ: 90°
• Cell volume: 2903.6 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1377
• Residual factor for significantly intense reflections: 0.0456
• Weighted residual factors for significantly intense reflections: 0.0943
• Weighted residual factors for all reflections included in the refinement: 0.1099
• Goodness-of-fit parameter for all reflections included in the refinement: 0.86
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No