Information card for entry 1547500

Structure parameters

• Formula: C19 H16 Cl N Pd Se
• Calculated formula: C19 H16 Cl N Pd Se
• SMILES: [Pd]12(c3c4c(cccc4C=[N]2CC[Se]1c1ccccc1)ccc3)Cl
• Title of publication: Sonogashira (Cu and amine free) and Suzuki coupling in air catalyzed <i>via</i> nanoparticles formed <i>in situ</i> from Pd( <scp>ii</scp> ) complexes of chalcogenated Schiff bases of 1-naphthaldehyde and their reduced forms
• Authors of publication: Bhaskar, Renu; Sharma, Alpesh K.; Yadav, Manoj K.; Singh, Ajai K.
• Journal of publication: Dalton Transactions
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 44
• Pages of publication: 15235 - 15248
• a: 5.5753 ± 0.0019 Å
• b: 8.462 ± 0.003 Å
• c: 36.235 ± 0.012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1709.5 ± 1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.041
• Residual factor for significantly intense reflections: 0.0393
• Weighted residual factors for significantly intense reflections: 0.0937
• Weighted residual factors for all reflections included in the refinement: 0.0946
• Goodness-of-fit parameter for all reflections included in the refinement: 1.146
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No