Information card for entry 4317633

Structure parameters

• Formula: C76 H68 Ag2 N4 O4 P2
• Calculated formula: C76 H68 Ag2 N4 O4 P2
• SMILES: [P]([Ag]12[n]3c(c4c(n3c3ccccc3)O[Ag]([O]=C4c3ccccc3)([P](c3c(cccc3)C)(c3c(cccc3)C)c3c(cccc3)C)[n]3c(c(c(n3c3ccccc3)O1)C(=[O]2)c1ccccc1)C)C)(c1c(cccc1)C)(c1c(C)cccc1)c1c(C)cccc1
• Title of publication: First Structurally Characterized Silver(I) Derivatives with Nonfluorinated β-Diketones
• Authors of publication: Augusto Cingolani; Effendy; Fabio Marchetti; Claudio Pettinari; Riccardo Pettinari; Brian W. Skelton; Allan H. White
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 1151 - 1161
• a: 11.8221 ± 0.0006 Å
• b: 13.2601 ± 0.0006 Å
• c: 20.5141 ± 0.001 Å
• α: 90°
• β: 91.758 ± 0.001°
• γ: 90°
• Cell volume: 3214.3 ± 0.3 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.065
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for all reflections: 0.042
• Weighted residual factors for all reflections included in the refinement: 0.038
• Goodness-of-fit parameter for all reflections: 0.936
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No