Information card for entry 4087502

Structure parameters

• Common name: jonlm03
• Chemical name: (dippe)Pd(k2-BT)
• Formula: C22.33 H38.67 Cl0.67 P2 Pd S
• Calculated formula: C22.3333 H38.6667 Cl0.666667 P2 Pd S
• Title of publication: Room-Temperature Carbon‒Sulfur Bond Activation by a Reactive (dippe)Pd Fragment
• Authors of publication: Munjanja, Lloyd; Brennessel, William W.; Jones, William D.
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 9
• Pages of publication: 1716
• a: 26.939 ± 0.004 Å
• b: 15.327 ± 0.002 Å
• c: 18.094 ± 0.003 Å
• α: 90°
• β: 95.577 ± 0.003°
• γ: 90°
• Cell volume: 7435.5 ± 1.9 ų
• Cell temperature: 100 ± 0.5 K
• Ambient diffraction temperature: 100 ± 0.5 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.101
• Residual factor for significantly intense reflections: 0.0461
• Weighted residual factors for significantly intense reflections: 0.0951
• Weighted residual factors for all reflections included in the refinement: 0.1154
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No