Information card for entry 2017902

Structure parameters

• Chemical name: Bis[<i>S</i>-benzyl-3-(4-<i>n</i>-octyloxybenzylidene)dithiocarbazato- κ^2^<i>N</i>^3^,<i>S</i>']palladium(II)
• Formula: C46 H58 N4 O2 Pd S4
• Calculated formula: C46 H58 N4 O2 Pd S4
• Title of publication: Bis[<i>S</i>-benzyl-3-(4-<i>n</i>-octyloxybenzylidene)dithiocarbazato-κ^2^<i>N</i>^3^,<i>S</i>']palladium(II)
• Authors of publication: Tarafder, M. T. H.; Islam, M. A. A. A. A.; Howlader, M. B. H.; Guidolin, N.; Zangrando, E.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 12
• Pages of publication: m363 - m365
• a: 16.586 ± 0.004 Å
• b: 14.082 ± 0.003 Å
• c: 10.507 ± 0.002 Å
• α: 90°
• β: 103.22 ± 0.03°
• γ: 90°
• Cell volume: 2389 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0843
• Residual factor for significantly intense reflections: 0.0364
• Weighted residual factors for significantly intense reflections: 0.0751
• Weighted residual factors for all reflections included in the refinement: 0.0828
• Goodness-of-fit parameter for all reflections included in the refinement: 0.77
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes