Information card for entry 7026292

Structure parameters

• Formula: C14 H32 N2 O6 Pd
• Calculated formula: C14 H32 N2 O6 Pd
• SMILES: [Pd]([NH2][C@H](CO)C(C)C)([NH2][C@H](CO)C(C)C)(OC(=O)C)OC(=O)C
• Title of publication: Synthesis of chiral β-aminoalcohol palladium complexes exhibiting cytotoxic properties.
• Authors of publication: Accadbled, Fabien; Tinant, Bernard; Hénon, Eric; Carrez, Danièle; Croisy, Alain; Bouquillon, Sandrine
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 38
• Pages of publication: 8982 - 8993
• a: 7.873 ± 0.003 Å
• b: 10.736 ± 0.004 Å
• c: 11.073 ± 0.004 Å
• α: 90°
• β: 95.92 ± 0.02°
• γ: 90°
• Cell volume: 930.9 ± 0.6 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0646
• Residual factor for significantly intense reflections: 0.0638
• Weighted residual factors for significantly intense reflections: 0.1667
• Weighted residual factors for all reflections included in the refinement: 0.169
• Goodness-of-fit parameter for all reflections included in the refinement: 1.203
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No