Information card for entry 7031201

Structure parameters

• Formula: C9 H13 Cl2 N Pd S
• Calculated formula: C9 H13 Cl2 N Pd S
• SMILES: c1ccccc1[S]1CCC[NH2][Pd]1(Cl)Cl
• Title of publication: Shape dependent catalytic activity of nanoflowers and nanospheres of Pd4S generated via one pot synthesis and grafted on graphene oxide for Suzuki coupling.
• Authors of publication: Singh, Ved Vati; Kumar, Umesh; Tripathi, Sandeep Nath; Singh, Ajai Kumar
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 33
• Pages of publication: 12555 - 12563
• a: 10.6716 ± 0.0018 Å
• b: 13.846 ± 0.002 Å
• c: 8.2794 ± 0.0014 Å
• α: 90°
• β: 108.956 ± 0.003°
• γ: 90°
• Cell volume: 1157 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 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: 0.0207
• Residual factor for significantly intense reflections: 0.0198
• Weighted residual factors for significantly intense reflections: 0.0486
• Weighted residual factors for all reflections included in the refinement: 0.049
• 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