Information card for entry 7001834

Structure parameters

• Formula: C54 H50 Cl4 N10 P2 Pd2
• Calculated formula: C54 H50 Cl4 N10 P2 Pd2
• SMILES: c12[Pd](N=N#N)([N](=Nc2cccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)CCCC[P](c1ccccc1)(c1ccccc1)[Pd]1(c2ccccc2N=[N]1c1ccccc1)N=N#N.C(Cl)Cl.C(Cl)Cl
• Title of publication: Cyclopalladated azido complexes containing C,N-donor (HCσim N = 2-(2′-thienyl)pyridine, azobenzene, 3,3′-dimethyl azobenzene, N,N′-dimethylbenzylamine, 2-phenylpyridine) ligands: reactivity towards organic unsaturated compounds and catalytic properties
• Authors of publication: Lee, Kyung-Eun; Jeon, Hyeong-Tak; Han, Sam-Yong; Ham, Jungyeob; Kim, Yong-Joo; Lee, Soon W.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 33
• Pages of publication: 6578 - 6592
• a: 19.0312 ± 0.0009 Å
• b: 9.1873 ± 0.0004 Å
• c: 16.2466 ± 0.0008 Å
• α: 90°
• β: 102.573 ± 0.002°
• γ: 90°
• Cell volume: 2772.5 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0638
• Residual factor for significantly intense reflections: 0.0392
• Weighted residual factors for significantly intense reflections: 0.0893
• Weighted residual factors for all reflections included in the refinement: 0.1004
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No