Information card for entry 7013527

Structure parameters

• Formula: C30 H40 N4 O14 Pd2
• Calculated formula: C30 H40 N4 O14 Pd2
• SMILES: C1(c2cccc[n]2[Pd]([n]2c1cccc2)(OC(=O)C)OC(=O)C)=C1c2cccc[n]2[Pd]([n]2c1cccc2)(OC(=O)C)OC(=O)C.O.O.O.O.O.O
• 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: 19.644 ± 0.008 Å
• b: 15.938 ± 0.006 Å
• c: 14.847 ± 0.006 Å
• α: 90°
• β: 125.925 ± 0.005°
• γ: 90°
• Cell volume: 3764 ± 3 ų
• Cell temperature: 168 ± 2 K
• Ambient diffraction temperature: 168 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0271
• Residual factor for significantly intense reflections: 0.023
• Weighted residual factors for significantly intense reflections: 0.062
• Weighted residual factors for all reflections included in the refinement: 0.0634
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No