Information card for entry 1553074

Structure parameters

• Formula: C20 H13 N O4
• Calculated formula: C20 H13 N O4
• SMILES: C1(=O)c2cccc3cccc(C(=O)N1Cc1ccc4c(c1)OCO4)c23
• Title of publication: Palladium nanoparticles in glycerol: a clear-cut catalyst for one-pot multi-step processes applied in the synthesis of heterocyclic compounds
• Authors of publication: Chahdoura, Faouzi; Mallet-Ladeira, Sonia; Gómez, Montserrat
• Journal of publication: Organic Chemistry Frontiers
• Year of publication: 2015
• Journal volume: 2
• Journal issue: 4
• Pages of publication: 312
• a: 7.1728 ± 0.0002 Å
• b: 8.0196 ± 0.0002 Å
• c: 12.8455 ± 0.0004 Å
• α: 84.142 ± 0.002°
• β: 89.687 ± 0.002°
• γ: 87.901 ± 0.002°
• Cell volume: 734.56 ± 0.04 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0478
• Residual factor for significantly intense reflections: 0.0379
• Weighted residual factors for significantly intense reflections: 0.0976
• Weighted residual factors for all reflections included in the refinement: 0.1044
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No