Information card for entry 7004251

Structure parameters

• Formula: C55 H65 Cl5 N6 Pd3
• Calculated formula: C55 H65 Cl5 N6 Pd3
• SMILES: [Pd]12([Cl][Pd]3(N(C(=CC(=[N]3c3ccccc3)C)C)c3ccccc3)[NH]2c2ccc(cc2)C(C)(C)C)[N](=C(C)C([Pd](Cl)(Cl)[NH2]c2ccc(cc2)C(C)(C)C)C(=[N]1c1ccccc1)C)c1ccccc1.ClCCl
• Title of publication: Novel dinuclear and trinuclear palladium β-diiminate complexes containing amido‒chloro double-bridges
• Authors of publication: Hadzovic, Alen; Janetzko, John; Song, Datong
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 25
• Pages of publication: 3279 - 3281
• a: 11.9402 ± 0.0003 Å
• b: 15.3099 ± 0.0007 Å
• c: 15.5713 ± 0.0005 Å
• α: 85.923 ± 0.002°
• β: 78.728 ± 0.002°
• γ: 88.962 ± 0.002°
• Cell volume: 2784.49 ± 0.17 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1021
• Residual factor for significantly intense reflections: 0.0634
• Weighted residual factors for significantly intense reflections: 0.1592
• Weighted residual factors for all reflections included in the refinement: 0.1845
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No