Information card for entry 2230462

Structure parameters

• Chemical name: Bis[μ-1,2-bis(1<i>H</i>-imidazol-1-ylmethyl)benzene- κ^2^<i>N</i>^3^:<i>N</i>^3'^]disilver(I) bis(4-carboxynaphthalene-1-carboxylate) tetrahydrate
• Formula: C52 H50 Ag2 N8 O12
• Calculated formula: C52 H50 Ag2 N8 O12
• SMILES: c1cn2c[n]1[Ag][n]1cn(Cc3c(Cn4cc[n](c4)[Ag][n]4cn(Cc5c(cccc5)C2)cc4)cccc3)cc1.O=C([O-])c1ccc(C(=O)O)c2c1cccc2.O.O.O=C(O)c1ccc(C(=O)[O-])c2c1cccc2.O.O
• Title of publication: Bis[μ-1,2-bis(1<i>H</i>-imidazol-1-ylmethyl)benzene-κ^2^<i>N</i>^3^:<i>N</i>^3'^]disilver(I) bis(4-carboxynaphthalene-1-carboxylate) tetrahydrate
• Authors of publication: Yang, Yan; Yuan, Guohui
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 6
• Pages of publication: m802
• a: 9.6644 ± 0.0005 Å
• b: 11.3769 ± 0.0012 Å
• c: 11.8255 ± 0.0005 Å
• α: 109.376 ± 0.008°
• β: 95.783 ± 0.003°
• γ: 94.442 ± 0.004°
• Cell volume: 1211.79 ± 0.16 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: 0.0466
• Residual factor for significantly intense reflections: 0.029
• Weighted residual factors for significantly intense reflections: 0.0665
• Weighted residual factors for all reflections included in the refinement: 0.0694
• Goodness-of-fit parameter for all reflections included in the refinement: 0.889
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes