Information card for entry 7101821

Structure parameters

• Formula: C24 H20 Ag N5 O5
• Calculated formula: C24 H20 Ag N5 O5
• SMILES: [Ag]([n]1ccc(cc1)C(=O)Nc1ccccc1)[n]1ccc(cc1)C(=O)Nc1ccccc1.O=N(=O)[O-]
• Title of publication: Single-crystal to single-crystal phase transitions of bis(N-phenylisonicotinamide)silver(I) nitrate reveal cooperativity properties in porous molecular materials.
• Authors of publication: Mukherjee, Partha S; Lopez, Nazario; Arif, Atta M; Cervantes-Lee, Francisco; Noveron, Juan C
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2007
• Journal issue: 14
• Pages of publication: 1433 - 1435
• a: 8.8731 ± 0.0001 Å
• b: 36.1311 ± 0.0005 Å
• c: 13.9696 ± 0.0002 Å
• α: 90°
• β: 93.3705 ± 0.0005°
• γ: 90°
• Cell volume: 4470.83 ± 0.1 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 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: 0.0774
• Residual factor for significantly intense reflections: 0.0414
• Weighted residual factors for significantly intense reflections: 0.0747
• Weighted residual factors for all reflections included in the refinement: 0.0843
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No