Information card for entry 4310271

Structure parameters

• Formula: C12 H8 Ag N5 O3
• Calculated formula: C12 H8 Ag N5 O3
• SMILES: c1c(ccc[n]1[Ag][n]1cc(ccc1)C#N)C#N.N(=O)(=O)[O-]
• Title of publication: New 1- and 2-Dimensional Polymeric Structures of Cyanopyridine Complexes of AgI and CuI
• Authors of publication: Ping Lin; Richard A. Henderson; Ross W. Harrington; William Clegg; Chuan-De Wu; Xin-Tao Wu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 181 - 188
• a: 27.356 ± 0.006 Å
• b: 6.5352 ± 0.0015 Å
• c: 3.7201 ± 0.0009 Å
• α: 90°
• β: 92.481 ± 0.004°
• γ: 90°
• Cell volume: 664.4 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0611
• Residual factor for significantly intense reflections: 0.059
• Weighted residual factors for significantly intense reflections: 0.1573
• Weighted residual factors for all reflections included in the refinement: 0.1624
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No