Information card for entry 4317634

Structure parameters

• Formula: C43 H40 Ag N6 O2 P S2
• Calculated formula: C43 H40 Ag N6 O2 P S2
• SMILES: [Ag]([P](c1ccccc1)(c1ccccc1)c1ccccc1)([S]=c1n(C)cc[nH]1)[S]=c1n(C)cc[nH]1.n1(c2ccccc2)nc(C)c(C(=O)c2ccccc2)c1[O-]
• 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: 11.553 ± 0.001 Å
• b: 11.943 ± 0.001 Å
• c: 15.479 ± 0.002 Å
• α: 74.829 ± 0.002°
• β: 76.094 ± 0.002°
• γ: 78.185 ± 0.002°
• Cell volume: 1977.8 ± 0.4 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.045
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for all reflections: 0.042
• Weighted residual factors for all reflections included in the refinement: 0.039
• Goodness-of-fit parameter for all reflections: 1.037
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No