Information card for entry 7022219

Structure parameters

• Formula: C22 H24 Ag2 Cl2 N10 O14
• Calculated formula: C22 H24 Ag2 Cl2 N10 O14
• SMILES: [Ag]12([O]=C3N(C(=O)N(C)c4nc(C)c(C(=[N]5O)C)[n]1c34)C)[O]=C1N(C)C(=O)N(C)c3nc(C)c([n]2c13)C(C)=[N](O)[Ag]5(OCl(=O)(=O)=O)OCl(=O)(=O)=O
• 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: 13.2412 ± 0.0013 Å
• b: 14.5295 ± 0.0015 Å
• c: 16.661 ± 0.003 Å
• α: 90°
• β: 105.675 ± 0.009°
• γ: 90°
• Cell volume: 3086.2 ± 0.7 ų
• Cell temperature: 77 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.2139
• Residual factor for significantly intense reflections: 0.1069
• Weighted residual factors for significantly intense reflections: 0.2694
• Weighted residual factors for all reflections included in the refinement: 0.3489
• Goodness-of-fit parameter for all reflections included in the refinement: 1.106
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No