Information card for entry 4089328

Structure parameters

• Formula: C15 H26 Cl N3 O4 Pd
• Calculated formula: C15 H26 Cl N3 O4 Pd
• SMILES: [Pd]12([NH2]C(CC(=[NH]1)C)(C)C)c1ccccc1C[N]2(C)C.Cl(=O)(=O)(=O)[O-]
• Title of publication: Acetimine and 2-Methyl-2-amino-4-iminopentane Complexes of Palladium(II)
• Authors of publication: Ruiz, José; Rodríguez, Venancio; Cutillas, Natalia; López, Gregorio; Pérez, José
• Journal of publication: Organometallics
• Year of publication: 2002
• Journal volume: 21
• Journal issue: 23
• Pages of publication: 4912
• a: 8.7427 ± 0.0004 Å
• b: 20.7105 ± 0.0011 Å
• c: 10.4411 ± 0.0006 Å
• α: 90°
• β: 92.641 ± 0.004°
• γ: 90°
• Cell volume: 1888.52 ± 0.17 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0454
• Residual factor for significantly intense reflections: 0.0357
• Weighted residual factors for significantly intense reflections: 0.0953
• Weighted residual factors for all reflections included in the refinement: 0.1
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 4089323
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No