Information card for entry 1101085

Structure parameters

• Formula: C26 H29 Cl3 N16 O19 Pd2
• Calculated formula: C26 H18 Cl3 N16 O19 Pd2
• Title of publication: Solution and solid state coexistence of head‒head and head‒tail isomers in dimeric Pd(II) and Pt(II) complexes of the type [M2(a‒a)2(µ-L-N3N4)2]2+ with a bridging triazolopyrimidine ligand and chelating bidentate diamines
• Authors of publication: Mohammad Abul Haj; Miguel Quirós; Juan M. Salas
• Journal of publication: J. Chem. Soc., Dalton Trans.
• Year of publication: 2002
• Journal issue: 24
• Pages of publication: 4740 - 4745
• a: 11.1799 ± 0.0014 Å
• b: 18.94 ± 0.0018 Å
• c: 9.6374 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2040.7 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 59
• Hermann-Mauguin space group symbol: P m m n :2
• Hall space group symbol: -P 2ab 2a
• Residual factor for all reflections: 0.1404
• Residual factor for significantly intense reflections: 0.0821
• Weighted residual factors for significantly intense reflections: 0.1705
• Weighted residual factors for all reflections included in the refinement: 0.2107
• Goodness-of-fit parameter for all reflections included in the refinement: 1.114
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No