Information card for entry 4074061

Structure parameters

• Formula: C94 H92 B2 F8 N10 Pd2 S2
• Calculated formula: C94 H92 B2 F8 N10 Pd2 S2
• Title of publication: Dipalladium Bis(μ-isopropylthiolato) Complexes with a [Pd2S2] Core Supported by N-Heterocyclic Carbenes
• Authors of publication: Huynh, Han Vinh; Jothibasu, Ramasamy; Koh, Lip Lin
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 27
• Pages of publication: 6852
• a: 16.6078 ± 0.0006 Å
• b: 15.3151 ± 0.0006 Å
• c: 18.868 ± 0.0007 Å
• α: 90°
• β: 104.095 ± 0.001°
• γ: 90°
• Cell volume: 4654.6 ± 0.3 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 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: 0.1178
• Residual factor for significantly intense reflections: 0.1077
• Weighted residual factors for significantly intense reflections: 0.2501
• Weighted residual factors for all reflections included in the refinement: 0.2551
• Goodness-of-fit parameter for all reflections included in the refinement: 1.28
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No