Information card for entry 3000549

Structure parameters

• Formula: C19 H29 Ag F3 N8 O5.5 S
• Calculated formula: C19 H29 Ag F3 N8 O5.5 S
• Title of publication: Silver Binding Dichotomy for 7-Deazaadenine/Thymine: Preference for Watson-Crick Pairing over Homobase Interactions in DNA.
• Authors of publication: López-Chamorro, Carmen; Pérez-Romero, Antonio; Domínguez-Martín, Alicia; Javornik, Uroš; Palacios, Oscar; Plavec, Janez; Galindo, Miguel A
• Journal of publication: Inorganic chemistry
• Year of publication: 2025
• Journal volume: 64
• Journal issue: 28
• Pages of publication: 14455 - 14465
• a: 9.7541 ± 0.0004 Å
• b: 13.908 ± 0.0006 Å
• c: 20.0815 ± 0.0007 Å
• α: 81.523 ± 0.001°
• β: 82.143 ± 0.001°
• γ: 78.681 ± 0.001°
• Cell volume: 2625.72 ± 0.18 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0475
• Residual factor for significantly intense reflections: 0.0454
• Weighted residual factors for significantly intense reflections: 0.1185
• Weighted residual factors for all reflections included in the refinement: 0.1205
• Goodness-of-fit parameter for all reflections included in the refinement: 1.162
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes