Information card for entry 7013523

Structure parameters

• Common name: 18
• Formula: C12 H12 Cl2 N2 O2 Pd
• Calculated formula: C12 H12 Cl2 N2 O2 Pd
• SMILES: [Pd]1(Cl)(Cl)[n]2c(C(OC)(O)c3[n]1cccc3)cccc2
• Title of publication: Coordination chemistry of di-2-pyridylmethane and related bridging ligands with silver(i), copper(ii), palladium(ii) and zinc(ii)
• Authors of publication: Steel, Peter J.; Sumby, Christopher J.
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 23
• Pages of publication: 4505
• a: 9.106 ± 0.003 Å
• b: 11.784 ± 0.005 Å
• c: 12.625 ± 0.004 Å
• α: 90°
• β: 91.509 ± 0.015°
• γ: 90°
• Cell volume: 1354.3 ± 0.8 ų
• Cell temperature: 168 ± 2 K
• Ambient diffraction temperature: 168 ± 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: 0.0441
• Residual factor for significantly intense reflections: 0.0311
• Weighted residual factors for significantly intense reflections: 0.0691
• Weighted residual factors for all reflections included in the refinement: 0.0716
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No