%0 Journal Article %T Analytical, Spectral, Thermal and Molecular Modeling Studies of Hg<sup>2+</sup>-2,3-Butanedionemonoxime Girard¡¯s T Hydrazone Complex and Its Application %A Najlaa S. Al-Radadi %A Magda M. Akl %A Mohamed A. Elbeshlawi %A Mohsen M. Mostafa %J Open Journal of Inorganic Chemistry %P 1-14 %@ 2161-7414 %D 2016 %I Scientific Research Publishing %R 10.4236/ojic.2016.61001 %X The coordination behavior of 2,3-butanedionemonoxime Girard¡¯s T hydrazone (L1) towards Hg2+ ion has been investigated. The structure of Hg2+ complex, [Hg(L1)Cl]Cl¡€5H2O, is elucidated using elemental analyses, spectral (IR, UV-visible, 1H-NMR and mass) and TGA measurements. IR spectrum suggests that L1 behaves in a bidentate manner through the azomethine groups. The molecular modeling of L1 and its Hg2+ complex has been investigated. The bond lengths, bond angles, HOMO and LUMO have been calculated. The thermal behavior and kinetic parameters are determined using Coats-Redfern method. The use of L1 for preconcentration and separation via flotation of Hg2+ complex and determination using cold vapor atomic spectrometry (CVAAS) is described. The effects on the percentage of recovered Hg2+ by pH of sample solutions, oleic acid (HOL) concentration, Hg2+ and L1 concentrations are studied in details. The method is applied for the determination of the total Hg2+ (mg¡€mL-1) in natural water samples. %K Mercury Complex %K 2 %K 3-Butanedionemonoxime Girard¡¯s T Hydrazone %K Modeling %K Spectral Studies %K Separation Using Flotation Method %U http://www.scirp.org/journal/PaperInformation.aspx?PaperID=62558