Information card for entry 7022864

Structure parameters

• Formula: C28 H27 Cl3 N2 O Pd
• Calculated formula: C28 H27 Cl3 N2 O Pd
• SMILES: [Pd]12([n]3c(c4c(O1)c(ccc4)c1ccccc1)cccc3C[NH]2c1c(cc(cc1C)C)C)Cl.C(Cl)Cl
• Title of publication: From discrete monomeric complexes to hydrogen-bonded dimeric assemblies based on sterically encumbered square planar palladium(II) ONN-pincers.
• Authors of publication: Adeyi, Okoh; Cross, Warren B.; Forrest, Gregory; Godfrey, Luke; Hope, Eric G.; McLeod, Andrew; Singh, Amandeep; Singh, Kuldip; Solan, Gregory A.; Wang, Yining; Wright, Luka A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 21
• Pages of publication: 7710 - 7723
• a: 9.632 ± 0.009 Å
• b: 11.597 ± 0.011 Å
• c: 13.229 ± 0.012 Å
• α: 90.567 ± 0.019°
• β: 108.415 ± 0.019°
• γ: 112.533 ± 0.018°
• Cell volume: 1280 ± 2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.1526
• Residual factor for significantly intense reflections: 0.1151
• Weighted residual factors for significantly intense reflections: 0.3053
• Weighted residual factors for all reflections included in the refinement: 0.3219
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No