Information card for entry 4304093

Structure parameters

• Formula: C40 H48 Cl4 N4 Pd2 Si4
• Calculated formula: C40 H48 Cl4 N4 Pd2 Si4
• SMILES: c12c[n]([Pd](Cl)(Cl)[n]3cccc(c3)[Si](c3ccc(cc3)[Si](c3ccc[n](c3)[Pd]([n]3cccc(c3)[Si](c3ccc(cc3)[Si]2(C)C)(C)C)(Cl)Cl)(C)C)(C)C)ccc1
• Title of publication: Subtle Ring-Constraint Effects on the Formation of Metallacycles. Cyclodimer versus Cyclotrimer of Bis(chloro)-1,4-bis(dimethyl-3 or 4-pyridylsilyl)benzenepalladium(II) Complexes
• Authors of publication: Young Mee Na; Tae Hwan Noh; In Sung Chun; Young-A Lee; Jongki Hong; Ok-Sang Jung
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 1391 - 1396
• a: 8.5122 ± 0.0006 Å
• b: 10.859 ± 0.0007 Å
• c: 13.319 ± 0.0009 Å
• α: 78.353 ± 0.001°
• β: 81.993 ± 0.001°
• γ: 78.284 ± 0.001°
• Cell volume: 1174.44 ± 0.14 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0585
• Residual factor for significantly intense reflections: 0.0358
• Weighted residual factors for significantly intense reflections: 0.079
• Weighted residual factors for all reflections included in the refinement: 0.0884
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No