Information card for entry 4344224

Structure parameters

• Formula: C120.36 H104.72 Cl0.72 F12 O12 P8 Pd4 S8
• Calculated formula: C120.362 H104.724 Cl0.724 F12 O12 P8 Pd4 S8
• Title of publication: Supramolecular Macrocyclic Pd(II) and Pt(II) Squares and Rectangles with Aryldithiolate Ligands and their Excellent Catalytic Activity in Suzuki C-C Coupling Reaction.
• Authors of publication: Vivekananda, K. V.; Dey, S.; Maity, D. K.; Bhuvanesh, N.; Jain, V. K.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 21
• Pages of publication: 10153 - 10162
• a: 13.145 ± 0.002 Å
• b: 14.789 ± 0.003 Å
• c: 16.778 ± 0.003 Å
• α: 79.209 ± 0.002°
• β: 85.456 ± 0.002°
• γ: 70.708 ± 0.002°
• Cell volume: 3023.5 ± 0.9 ų
• Cell temperature: 110.15 K
• Ambient diffraction temperature: 110.15 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0338
• Residual factor for significantly intense reflections: 0.027
• Weighted residual factors for significantly intense reflections: 0.06
• Weighted residual factors for all reflections included in the refinement: 0.0639
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No