Information card for entry 4318228

Structure parameters

• Common name: [Pd(S2cyclophane)2][SO3CF3]2
• Formula: C36 H32 F6 N O6 Pd S6
• Calculated formula: C36 H32 F6 N O6 Pd S6
• Title of publication: Conformational Behavior and Coordination Chemistry of 2,11-Dithia[3.3]orthocyclophane with Platinum Group Metals
• Authors of publication: Jorge Tiburcio; William D. Jones; Stephen J. Loeb; Hugo Torrens
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 3779 - 3785
• a: 9.4421 ± 0.0005 Å
• b: 21.7356 ± 0.0011 Å
• c: 19.1037 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3920.6 ± 0.4 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 7
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0582
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for significantly intense reflections: 0.0855
• Weighted residual factors for all reflections included in the refinement: 0.0913
• Goodness-of-fit parameter for all reflections included in the refinement: 1.115
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No