Information card for entry 2202865

Structure parameters

• Chemical name: Tris(1,6-diaminohexane)diterephthalatotetrasilver(I) dihydrate
• Formula: C17 H30 Ag2 N3 O5
• Calculated formula: C17 H30 Ag2 N3 O5
• SMILES: [Ag](OC(=O)c1ccc(cc1)C(=O)[O-])[NH2]CCCCCC[NH2][Ag][NH2]CCCCCC[NH2][Ag][NH2]CCCCCC[NH2][Ag]OC(=O)c1ccc(cc1)C(=O)[O-].O.O
• Title of publication: Tris(μ-1,6-diaminohexane)diterephthalatotetrasilver(I) dihydrate
• Authors of publication: Zhu, Hai-Liang; Wang, Zao-Gui; Lin, Yong-Shan; Zou, Ying; Tang, Lu-Lu; Shao, Si-Chang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 10
• Pages of publication: m942 - m943
• a: 7.22 ± 0.001 Å
• b: 10.928 ± 0.002 Å
• c: 13.919 ± 0.003 Å
• α: 110.08 ± 0.03°
• β: 98.73 ± 0.03°
• γ: 96.31 ± 0.03°
• Cell volume: 1003.9 ± 0.4 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: 0.0422
• Residual factor for significantly intense reflections: 0.0371
• Weighted residual factors for significantly intense reflections: 0.09
• Weighted residual factors for all reflections included in the refinement: 0.0926
• 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: Yes