Information card for entry 7028232

Structure parameters

• Formula: C25 H25 Cl N4 O Pd
• Calculated formula: C25 H25 Cl N4 O Pd
• SMILES: [Pd]1(C(=Nc2c(cccc2C)C)c2c(cccc2)C(=[N]1O)N)(Cl)C#[N]c1c(cccc1C)C
• Title of publication: Cyclopalladated complexes derived from benzamidoxime.
• Authors of publication: Abellán-López, Antonio; Chicote, María-Teresa; Bautista, Delia; Vicente, José
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 2
• Pages of publication: 592 - 598
• a: 14.058 ± 0.007 Å
• b: 11.058 ± 0.005 Å
• c: 14.952 ± 0.007 Å
• α: 90°
• β: 94.647 ± 0.008°
• γ: 90°
• Cell volume: 2316.7 ± 1.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0339
• Residual factor for significantly intense reflections: 0.0304
• Weighted residual factors for significantly intense reflections: 0.0751
• Weighted residual factors for all reflections included in the refinement: 0.0776
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No