The geometries and energies of the electronic states of phenyloxenium ion 1 (Ph-O(+)) were computed at the multireference CASPT2/pVTZ level of theory. Despite being isoelectronic to phenylnitrene 4, the phenyloxenium ion 1 has remarkably different energetic orderings of its electronic states. The closed-shell singlet configuration ((1)A(1)) is the ground state of the phenyloxenium ion 1, with a...

The true oxidation state of formally 'H(-)' ions incorporated in an oxide host is frequently discussed in connection with chemical shifts of (1)H nuclear magnetic resonance spectroscopy, as they can exhibit values typically attributed to H(+). Here we systematically investigate the link between geometrical structure and chemical shift of H(-) ions in an oxide host, mayenite, with a combination ...

Oxime extractants 3-tert-butyl-2-hydroxy-5-methyl benzaldehyde oxime (HL1) and 3-tert-butyl-2-hydroxy-5-methoxy benzaldehyde oxime (HL2) were synthesized and characterized by conventional spectroscopic methods. Suitable lipophilic nature of the prepared extractants allowed examining the ability of these molecules for extr...

A new carboxylic acid extractant, named 2-(dibutylcarbamoyl)benzoic acid, is prepared and its potential for selective solvent extraction and recovery of lead ions from industrial samples was investigated. The slope analysis indicated that the lead ions are extracted by formation of 1:2 metal to ligand complexes. The effect of the parameters influencing the extraction efficiency including kind o...

the present work concerns on the investigation of the role of polyethylene glycols (pegs) as masking agent for amelioration of extraction-separation of la(iii), eu(iii) and er(iii) ions by the acidic extractant bis(2-ethylhexyl)phosphoric acid (dehpa). the studied solvent extraction system is based on the combination of chelating effect of dehpa in the organic phase on the one hand, and the bin...

the extraction-separation of lanthanum and europium ions with bis(2-ethylhexyl) phosphoric acid (dehpa) in cyclohexane was improved by adding 12-crown-4 (12c4) to the aqueous phase as a masking agent. in the presence of this crown ether the extraction curve of lanthanum ions versus ph shifts to the higher ph region, while the curve is not influenced for the europium ions. consequently the separ...