Information card for entry 7018021

Structure parameters

• Formula: C10 H28 Br2 O P4 Pd2 S
• Calculated formula: C10 H28 Br2 O P4 Pd2 S
• SMILES: C1[P](C)(C)[Pd]2([P](C[P](C)(C)[Pd]([P]1(C)C)(S2=O)Br)(C)C)Br
• Title of publication: Reactivity of the bridged-sulfide complex Pd(2)Cl(2)(μ-S)(μ-dmpm)(2) toward electrophiles.
• Authors of publication: Pamplin, Craig B.; Rettig, Steven J.; Patrick, Brian O.; James, Brian R.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 7
• Pages of publication: 1991 - 2002
• a: 10.7943 ± 0.0011 Å
• b: 13.7756 ± 0.0003 Å
• c: 14.8223 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2204 ± 0.2 ų
• Cell temperature: 180 ± 1 K
• Ambient diffraction temperature: 180 ± 1 K
• Number of distinct elements: 7
• 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: 0.0294
• Residual factor for significantly intense reflections: 0.0259
• Weighted residual factors for significantly intense reflections: 0.0626
• Weighted residual factors for all reflections included in the refinement: 0.0658
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No