Information card for entry 4321952

Structure parameters

• Formula: C35 H61 Cl4 N5 O17 Pd
• Calculated formula: C35 H61 Cl4 N5 O17 Pd
• SMILES: [Pd]12(Cl)[N]3(C)CC[N]1(C)Cc1ccc(cc1)C[NH+]1CCOCCOCC[NH+](CCOCCOCC1)Cc1ccc(cc1)C[N]2(C)CC3.O.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-]
• Title of publication: Palladium(II) Complexation byp-Cyclophane Receptors. A Solution and Solid State Study
• Authors of publication: Andrea Bencini; Antonio Bianchi; Vieri Fusi; Claudia Giorgi; Piero Paoletti; Jose; Antonio; Ramirez'; Barbara Valtancoli
• Journal of publication: Inorganic Chemistry
• Year of publication: 1999
• Journal volume: 38
• Pages of publication: 2064 - 2070
• a: 23.739 ± 0.005 Å
• b: 13.37 ± 0.005 Å
• c: 14.903 ± 0.005 Å
• α: 90 ± 0.005°
• β: 90 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 4730 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.2359
• Residual factor for significantly intense reflections: 0.064
• Weighted residual factors for all reflections: 0.2261
• Weighted residual factors for significantly intense reflections: 0.151
• Goodness-of-fit parameter for all reflections: 0.987
• Goodness-of-fit parameter for significantly intense reflections: 1.106
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No