Information card for entry 7025674

Structure parameters

• Common name: [Pd2(en)2(2-Deoxy-/b-D-Galf1,3,5,6H-4)]*8H2O
• Formula: C10 H40 N4 O13 Pd2
• Calculated formula: C10 H40 N4 O13 Pd2
• SMILES: [Pd]12(O[C@@H]([C@@H]3O[C@H]4O[Pd]5(O[C@@H]3C4)[NH2]CC[NH2]5)CO1)[NH2]CC[NH2]2.O.O.O.O.O.O.O.O
• Title of publication: Metal chelation by the common 2-amino-2-deoxy-, 2-N-acetylamino-2-deoxy-, and 2-deoxy-hexoses.
• Authors of publication: Schwarz, Thomas; Hess, David; Klüfers, Peter
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 23
• Pages of publication: 5544 - 5555
• a: 10.1214 ± 0.0007 Å
• b: 8.5521 ± 0.001 Å
• c: 12.8909 ± 0.0008 Å
• α: 90°
• β: 91.738 ± 0.005°
• γ: 90°
• Cell volume: 1115.31 ± 0.17 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0242
• Residual factor for significantly intense reflections: 0.0207
• Weighted residual factors for significantly intense reflections: 0.0428
• Weighted residual factors for all reflections included in the refinement: 0.0436
• Goodness-of-fit parameter for all reflections included in the refinement: 0.991
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No