Information card for entry 7054346

Structure parameters

• Formula: C58 H58 Ag N13 O8
• Calculated formula: C58 H58 Ag N13 O8
• SMILES: [Ag]12([n]3c(n(C)c4ccccc34)CN(c3ccccc3)Cc3n(C)c4ccccc4[n]13)[n]1c(n(C)c3ccccc13)CN(c1ccccc1)Cc1n(C)c3ccccc3[n]21.[O-]c1c(cc(cc1N(=O)=O)N(=O)=O)N(=O)=O.O(CC)CC
• Title of publication: DNA-binding studies and antioxidant activities of two-, three- and four-coordinate silver(i) complexes containing bis(2-benzimidazolyl)aniline derivatives
• Authors of publication: Wu, Huilu; Zhang, Yanhui; Chen, Chengyong; Zhang, Jiawen; Bai, Yuchen; Shi, Furong; Wang, Xiaoli
• Journal of publication: New Journal of Chemistry
• Year of publication: 2014
• Journal volume: 38
• Journal issue: 8
• Pages of publication: 3688
• a: 14.0351 ± 0.0016 Å
• b: 15.1423 ± 0.0012 Å
• c: 15.6532 ± 0.0018 Å
• α: 106.739 ± 0.008°
• β: 116.252 ± 0.001°
• γ: 98.591 ± 0.007°
• Cell volume: 2704.7 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0478
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.0985
• Weighted residual factors for all reflections included in the refinement: 0.106
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7054194
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No