Information card for entry 7043524

Structure parameters

• Formula: C28 H24 N2 O2 S
• Calculated formula: C28 H24 N2 O2 S
• SMILES: c1c(N(C(=O)CSCC(=O)N(c2ccccc2)c2ccccc2)c2ccccc2)cccc1
• Title of publication: Palladium(II) complexes of N, N-diphenylacetamide based thio/selenoethers and flower shaped Pd16S7 and prismatic Pd17Se15 nano-particles tailored from them as catalysts for C−C and C−O coupling
• Authors of publication: Singh, Poornima; Singh, Ajai kumar
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 17.766 ± 0.007 Å
• b: 5.557 ± 0.002 Å
• c: 13.792 ± 0.005 Å
• α: 90°
• β: 120.633 ± 0.008°
• γ: 90°
• Cell volume: 1171.6 ± 0.8 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.1168
• Residual factor for significantly intense reflections: 0.0804
• Weighted residual factors for significantly intense reflections: 0.1166
• Weighted residual factors for all reflections included in the refinement: 0.1283
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No