6533b858fe1ef96bd12b5726

RESEARCH PRODUCT

Influence of tetrahedral distortion of CuN4 complexes on spectroscopic properties. Synthesis, characterization and crystal structures of [Cu(N-(2-methylpyridyl)benzenesulfonylamidate)2], [Cu(N-(2-methylpyridyl)toluenesulfonylamidate)2] and [Cu(N-(2-methylpyridyl)naphthalenesulfonylamidate)2] compounds

Francisco SanzMalva Liu-gonzálezLaura GutierrezAlfonso CastiñeirasGloria AlzuetJoaquín Borrás

subject

DenticityTetracoordinateChemistrychemistry.chemical_elementCrystal structureChromophoreCopperInorganic ChemistryMetalchemistry.chemical_compoundCrystallographyvisual_artPyridineMaterials Chemistryvisual_art.visual_art_mediumPhysical and Theoretical ChemistrySingle crystal

description

Abstract A series of new N-sulfonamide ligands and their copper(II) complexes, [Cu(N-(2-methylpyridyl)toluenesulfonylamidate)2] (1), [Cu(N-(2-methylpyridyl)benzenesulfonylamidate)2] (2) and [Cu(N-(2-methylpyridyl)naphthalenesulfonylamidate)2] (3), have been synthesized and characterized. Single crystal X-ray analysis of the three complexes revealed that all of them present a tetracoordinate CuN4 chromophore. The ligands act as bidentate, coordinating the metal ion through the pyridine and sulfonamido N atoms. The main structural difference among the compounds is the varied degree of distortion of square-planar stereochemistry. Complex 1 exhibits a regular square-planar geometry. In complexes 2 and 3 the tetrahedrality values of 50.2° and 39.0° respectively indicate a strong distortion. EHMO calculations on idealized models show the correlation between the geometrical distortion and the spectroscopic properties.

https://doi.org/10.1016/s0277-5387(01)00717-3