Information card for entry 7034748

Structure parameters

• Formula: C66 H64 Br Cl13 P4 Pd2 S2
• Calculated formula: C66 H64 Br Cl13 P4 Pd2 S2
• Title of publication: Polydentate chalcogen reagents for the facile preparation of Pd2 and Pd4 complexes.
• Authors of publication: Azizpoor Fard, Mahmood; Willans, Mathew J.; Khalili Najafabadi, Bahareh; Levchenko, Tetyana I.; Corrigan, John F.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 17
• Pages of publication: 8267 - 8277
• a: 17.4473 ± 0.0008 Å
• b: 23.7638 ± 0.0011 Å
• c: 18.3345 ± 0.0009 Å
• α: 90°
• β: 103.015 ± 0.002°
• γ: 90°
• Cell volume: 7406.5 ± 0.6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1167
• Residual factor for significantly intense reflections: 0.0538
• Weighted residual factors for significantly intense reflections: 0.1194
• Weighted residual factors for all reflections included in the refinement: 0.1493
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No