Information card for entry 7007714

Structure parameters

• Common name: (Pd(1)I)2
• Formula: C32 H36 I2 P2 Pd2 S2
• Calculated formula: C31.99 H35.99 I2 P2 Pd2 S2
• Title of publication: Synthesis and characterisation of benzyl phosphino-thioether and -thiolato Pd(II) complexes and their applications in Suzuki coupling reactions.
• Authors of publication: Dervisi, Athanasia; Koursarou, Despina; Ooi, Li-Ling; Horton, Peter N.; Hursthouse, Michael B.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 48
• Pages of publication: 5717 - 5724
• a: 14.5082 ± 0.0001 Å
• b: 16.0768 ± 0.0002 Å
• c: 29.9895 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6994.91 ± 0.11 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0595
• Residual factor for significantly intense reflections: 0.0367
• Weighted residual factors for significantly intense reflections: 0.0776
• Weighted residual factors for all reflections included in the refinement: 0.086
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No