Information card for entry 7205434

Structure parameters

• Formula: C56 H36 Ag4 N8 O16
• Calculated formula: C56 H36 Ag4 N8 O16
• SMILES: c1cc(cc[n]1[Ag]123[O]=C(O)c4ccccc4C4=[O][Ag]5([n]6ccc(cc6)C#N)([O]=C(O)c6ccccc6C(O3)=[O][Ag]2([n]2ccc(cc2)C#N)OC(=[O]1)c1c(C(=O)O)cccc1)OC(=[O][Ag]5(O4)[n]1ccc(cc1)C#N)c1c(C(=O)O)cccc1)C#N
• Title of publication: pH-Dependent Ag(i) coordination architectures constructed from 4-cyanopyridine and phthalic acid: from discrete structure to 2D sheet
• Authors of publication: Sun, Di; Wei, Zhan-Hua; Yang, Cheng-Feng; Wang, Dan-Feng; Zhang, Na; Huang, Rong-Bin; Zheng, Lan-Sun
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 5
• Pages of publication: 1591
• a: 7.8033 ± 0.0016 Å
• b: 12.222 ± 0.002 Å
• c: 14.569 ± 0.003 Å
• α: 108.39 ± 0.03°
• β: 99.67 ± 0.03°
• γ: 95.65 ± 0.03°
• Cell volume: 1282.6 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.1087
• Residual factor for significantly intense reflections: 0.0885
• Weighted residual factors for significantly intense reflections: 0.2239
• Weighted residual factors for all reflections included in the refinement: 0.2584
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No