Information card for entry 7205555

Structure parameters

• Formula: C12 H19 Cl2 N6 O Pd
• Calculated formula: C12 H19 Cl2 N6 O Pd
• SMILES: [Pd]1(Cl)(Cl)N2N(C(=O)N(N=C2c2[n]1ccn2C)C(C)C)C(C)C
• Title of publication: Magnetostructural studies of palladium(ii) and platinum(ii) complexes of verdazyl radicals
• Authors of publication: McKinnon, Stephen D. J.; Gilroy, Joe B.; McDonald, Robert; Patrick, Brian O.; Hicks, Robin G.
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2011
• Journal volume: 21
• Journal issue: 5
• Pages of publication: 1523
• a: 11.0168 ± 0.0006 Å
• b: 10.3045 ± 0.0006 Å
• c: 14.9488 ± 0.0009 Å
• α: 90°
• β: 96.9769 ± 0.0008°
• γ: 90°
• Cell volume: 1684.46 ± 0.17 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 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: 0.0211
• Residual factor for significantly intense reflections: 0.0195
• Weighted residual factors for significantly intense reflections: 0.0498
• Weighted residual factors for all reflections included in the refinement: 0.0509
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No