Information card for entry 7022221

Structure parameters

• Formula: C28 H34 Ag2 F6 N10 O14 S2
• Calculated formula: C28 H34 Ag2 F6 N10 O14 S2
• SMILES: [Ag](OS(=O)(=O)C(F)(F)F)(OS(=O)(=O)C(F)(F)F)([N](O)=C(C)c1[n]2c3c(N(C(=O)N(C3=[O]3)C)C)nc1C)[N](O)=C(C)c1[n]([Ag]234[OH]CC)c2c(N(C(=O)N(C2=[O]4)C)C)nc1C.OCC
• Title of publication: Heteropolyhedral silver compounds containing the polydentate ligand N,N,O-E-[6-(hydroxyimino)ethyl]-1,3,7-trimethyllumazine. Preparation, spectral and XRD structural study and AIM calculations.
• Authors of publication: Jiménez-Pulido, Sonia B; Hueso-Ureña, Francisco; Fernández-Liencres, M Paz; Fernández-Gómez, Manuel; Moreno-Carretero, Miguel N
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 2
• Pages of publication: 530 - 541
• a: 14.6665 ± 0.0019 Å
• b: 15.0893 ± 0.0009 Å
• c: 19.703 ± 0.003 Å
• α: 90°
• β: 105.714 ± 0.01°
• γ: 90°
• Cell volume: 4197.4 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.0987
• Residual factor for significantly intense reflections: 0.0536
• Weighted residual factors for significantly intense reflections: 0.131
• Weighted residual factors for all reflections included in the refinement: 0.1597
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No