Information card for entry 7202344

Structure parameters

• Formula: C50 H47 Ag2 N15 O10
• Calculated formula: C50 H47 Ag2 N15 O10
• SMILES: [Ag]([n]1ccc(cc1)NC(=O)Nc1ccccc1)[n]1ccc(cc1)NC(=O)Nc1ccccc1.C(#N)C.N(=O)(=O)[O-]
• Title of publication: Silver(I) complexes of N-4-halophenyl-N′-4-pyridyl ureas. Isostructurality, urea⋯nitrate hydrogen bonding, and Ag⋯halogen interaction
• Authors of publication: Chandran, Sreekanth K.; Thakuria, Ranjit; Nangia, Ashwini
• Journal of publication: CrystEngComm
• Year of publication: 2008
• Journal volume: 10
• Journal issue: 12
• Pages of publication: 1891
• a: 19.4555 ± 0.0012 Å
• b: 25.7212 ± 0.0016 Å
• c: 10.2172 ± 0.0006 Å
• α: 90°
• β: 102.625 ± 0.001°
• γ: 90°
• Cell volume: 4989.3 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.0378
• Residual factor for significantly intense reflections: 0.0307
• Weighted residual factors for significantly intense reflections: 0.0742
• Weighted residual factors for all reflections included in the refinement: 0.0787
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No