Information card for entry 2018935

Structure parameters

• Chemical name: <i>catena</i>-Poly[[silver(I)-μ-{2-[2-(pyridin-4-yl)-1<i>H</i>-benzimidazol-1-ylmethyl]phenol-κ^2^<i>N</i>^2^:<i>N</i>^3^}] perchlorate monohydrate]
• Formula: C19 H17 Ag Cl N3 O6
• Calculated formula: C19 H17 Ag Cl N3 O6
• SMILES: [Ag]([N]1c2c(cccc2)N(C=1c1ccncc1)Cc1ccccc1O)[n]1ccc(C2N(c3ccccc3[N]=2[Ag])Cc2ccccc2O)cc1.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].O.O
• Title of publication: A one-dimensional silver(I) coordination polymer based on the 2-[2-(pyridin-4-yl)-1<i>H</i>-benzimidazol-1-ylmethyl]phenol ligand exhibiting photoluminescence
• Authors of publication: Hu, Dong-Cheng; Xiao, Chao-Hu; Guo, Guo-Zhe; Yang, Yun-Xia; Liu, Jia-Cheng
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 4
• Pages of publication: 356 - 359
• a: 9.739 ± 0.003 Å
• b: 21.26 ± 0.007 Å
• c: 9.952 ± 0.003 Å
• α: 90°
• β: 103.851 ± 0.003°
• γ: 90°
• Cell volume: 2000.7 ± 1.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0512
• Residual factor for significantly intense reflections: 0.0383
• Weighted residual factors for significantly intense reflections: 0.0902
• Weighted residual factors for all reflections included in the refinement: 0.0983
• Goodness-of-fit parameter for all reflections included in the refinement: 1.119
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes