Information card for entry 7001708

Structure parameters

• Formula: C89 H78 Cl3 F6 Fe2 N2 O10.5 P4 Pd2 S2
• Calculated formula: C89 H78 Cl3 F6 Fe2 N2 O10.5 P4 Pd2 S2
• Title of publication: Na+ and Ca2+ ion selective pyridylcarboxylate rings of Pd(II) and Pt(II)
• Authors of publication: Teo, Peili; Koh, L. L.; Hor, T. S. Andy
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 29
• Pages of publication: 5637
• a: 27.515 ± 0.005 Å
• b: 34.233 ± 0.005 Å
• c: 19.337 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 18214 ± 5 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 10
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.1259
• Residual factor for significantly intense reflections: 0.079
• Weighted residual factors for significantly intense reflections: 0.1696
• Weighted residual factors for all reflections included in the refinement: 0.191
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No