Information card for entry 7001835

Structure parameters

• Formula: C34 H44 Cl4 N8 P2 Pd2
• Calculated formula: C34 H44 Cl4 N8 P2 Pd2
• SMILES: c12[Pd](N=N#N)([n]3c(c2cccc1)cccc3)[P](CC)(CC[P](CC)(CC)[Pd]1(c2ccccc2c2cccc[n]12)N=N#N)CC.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: 11.5919 ± 0.0014 Å
• b: 16.83 ± 0.002 Å
• c: 10.5581 ± 0.0013 Å
• α: 90°
• β: 101.612 ± 0.005°
• γ: 90°
• Cell volume: 2017.6 ± 0.4 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: 0.0548
• Residual factor for significantly intense reflections: 0.0408
• Weighted residual factors for significantly intense reflections: 0.1093
• Weighted residual factors for all reflections included in the refinement: 0.1197
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No