Information card for entry 7202340

Structure parameters

• Formula: C26 H23 Ag Br2 N8 O5
• Calculated formula: C26 H23 Ag Br2 N8 O5
• SMILES: [Ag]([n]1ccc(cc1)NC(=O)Nc1ccc(Br)cc1)[n]1ccc(cc1)NC(=O)Nc1ccc(Br)cc1.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: 9.5477 ± 0.0005 Å
• b: 12.3303 ± 0.0006 Å
• c: 12.8922 ± 0.0007 Å
• α: 84.597 ± 0.001°
• β: 79.376 ± 0.001°
• γ: 71.709 ± 0.001°
• Cell volume: 1415.29 ± 0.13 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0229
• Residual factor for significantly intense reflections: 0.0212
• Weighted residual factors for significantly intense reflections: 0.0542
• Weighted residual factors for all reflections included in the refinement: 0.055
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No