Information card for entry 2205030

Structure parameters

• Chemical name: 3,3'-(p-phenylenedimethylene)bis(1-methylimiadzolium)‒tetrachloroargentate(I) (3/2)
• Formula: C48 H60 Ag2 Cl8 N12
• Calculated formula: C48 H60 Ag2 Cl8 N12
• SMILES: c1[n+](C)ccn1Cc1ccc(cc1)Cn1c[n+](cc1)C.[n]1(C)cn(cc1)Cc1ccc(Cn2c[n+](C)cc2)cc1.[Ag](Cl)([Cl-])([Cl-])[Cl-].C[n+]1cn(cc1)Cc1ccc(cc1)Cn1c[n+](cc1)C.[Ag](Cl)([Cl-])([Cl-])[Cl-]
• Title of publication: 3,3'-(<i>p</i>-Phenylenedimethylene)bis(1-methylimidazolium)‒tetrachloroargentate(I) (3/2)
• Authors of publication: Wang, Jun-Wen; Xu, Feng-Bo; Li, Qing-Shan; Song, Hai-Bin; Zhang, Zheng-Zhi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 2
• Pages of publication: m367 - m369
• a: 9.111 ± 0.003 Å
• b: 18.921 ± 0.007 Å
• c: 16.536 ± 0.005 Å
• α: 90°
• β: 92.368 ± 0.006°
• γ: 90°
• Cell volume: 2848.2 ± 1.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0951
• Residual factor for significantly intense reflections: 0.0506
• Weighted residual factors for significantly intense reflections: 0.1156
• Weighted residual factors for all reflections included in the refinement: 0.1315
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No