Information card for entry 1565727

Structure parameters

• Formula: C24 H30 I4 N4 O6 Pd
• Calculated formula: C24 H30 I4 N4 O6 Pd
• SMILES: c12O[Pd]3([N](=Cc2cc(cc1I)I)CCO)[N](=Cc1c(c(cc(c1)I)I)O3)CCO.C(=O)N(C)C.C(=O)N(C)C
• Title of publication: Crystal structure and evaluating C H⋯π (aryl/chelate) interactions in bis(2-{[(2-hydroxyethyl)imino]-methyl}-4,6-diiodophenolato)-palladium(II) Schiff base complex derived from (E)-2-(((2-hydroxyethyl)imino)methyl)-4,6-diiodophenol
• Authors of publication: Jebastin Andrews, S.G.; Benita Jeba Silviya, S.; Bhuvanesh, Nattamai S.P.; Janet Sylvia Jaba Rose, J.; Winfred Jebaraj, J.; Balakrishnan, Chithiraivel
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2019
• Journal volume: 498
• Pages of publication: 119118
• a: 5.0844 ± 0.0001 Å
• b: 12.9078 ± 0.0003 Å
• c: 23.7918 ± 0.0006 Å
• α: 90°
• β: 92.651 ± 0.001°
• γ: 90°
• Cell volume: 1559.75 ± 0.06 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0251
• Residual factor for significantly intense reflections: 0.0226
• Weighted residual factors for significantly intense reflections: 0.0445
• Weighted residual factors for all reflections included in the refinement: 0.0456
• Goodness-of-fit parameter for all reflections included in the refinement: 1.183
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No