Information card for entry 1100171

Structure parameters

• Chemical name: Bis(4,5-dihydro-1,2,4-triazolo[1,5-a]pyrimidinate-5-one-mu-N3,N4) bis(trans-diaminociclohexane) dipalladium(II) nitrate tetrahydrate
• Formula: C22 H40 N14 O11 Pd2
• Calculated formula: C22 H34 N14 O11 Pd2
• Authors of publication: Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas
• Journal of publication: Polyhedron
• Year of publication: 2004
• Journal volume: 23
• Pages of publication: 2373 - 2379
• a: 10.2842 ± 0.0015 Å
• b: 18.92 ± 0.003 Å
• c: 18.45 ± 0.003 Å
• α: 90°
• β: 104.117 ± 0.01°
• γ: 90°
• Cell volume: 3481.5 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0604
• Residual factor for significantly intense reflections: 0.0487
• Weighted residual factors for significantly intense reflections: 0.1171
• Weighted residual factors for all reflections included in the refinement: 0.1238
• Goodness-of-fit parameter for all reflections included in the refinement: 1.136
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No