Search Results - "Nicolaides, Athanassios V"
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Surface mechanism of the boron adsorption on alumina in aqueous solutions
Published in Desalination and water treatment (01-09-2013)“…The adsorption of boron (boric acid) from aqueous solutions on alumina has been investigated at pH 8.0, I = 0.1M NaClO4, T = 22 ± 3°C, and under normal…”
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Tricyclo-[3.3.1.0]nonane-3,7-diyl bis-(methane-sulfonate)
Published in Acta crystallographica. Section E, Structure reports online (20-01-2010)“…The crystal structure of the title compound, C(11)H(18)O(6)S(2), was determined to investigate the effect of the eclipsed mesyl groups on the bond length of…”
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3
Electron affinities of a homologous series of tertiary alkyl radicals and their C–H bond dissociation energies (BDEs)
Published in Tetrahedron (21-02-2009)“…Heats of formation have been derived from G3(MP2)//B3LYP and G3MP2B3(+) atomization energies for tert-butyl radical ( 6R), cubyl radical, bicyclooctyl radical…”
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4
A computational study on the possible role of oxygen in the oxidation of methionine and dimethylsulfide initiated by OH radicals
Published in Computational and theoretical chemistry (01-04-2013)“…[Display omitted] ► Molecular oxygen can oxidize sulfur radical cations to carbocations in solution. ► Molecular oxygen can oxidize peroxy radicals to carbonyl…”
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5
An improved synthesis of diiodonoradamantane
Published in Tetrahedron letters (16-12-2009)“…Τhe synthesis of 3,7-diiodo-tricyclo[3.3.1.0 3,7]nonane, the main precursor of noradamantene, by iodination of the corresponding diol via its dimesylate…”
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Synthesis of a novel diene from a cyclobutane precursor: an entry to 2,9-disubstituted [2]diadamantanes
Published in Tetrahedron (16-09-2013)“…In the gas-phase thermolysis (350 °C) of heptacyclic cyclobutane 2, n=1, (the [2+2] dimer of noradamantene) two isomeric dienes (the symmetric 5, n=1 and the…”
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Corrigendum to “An improved synthesis of diiodonoradamantane” [Tetrahedron Lett. 50 (2009) 6938–6940]
Published in Tetrahedron letters (12-05-2010)Get full text
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8
A computational study of the conformations of the boric acid (B(OH)3), its conjugate base ((HO)2BO−) and borate anion
Published in Journal of molecular structure. Theochem (01-03-2008)Get full text
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A computational study of the conformations of the boric acid (B(OH) 3), its conjugate base ((HO) 2BO −) and borate anion ( B(OH) 4 − )
Published in Journal of molecular structure. Theochem (31-03-2008)“…The conformations of boric acid ( 1), its conjugate basis ( 2) and borate anion ( 3) have been investigated with the B3LYP, HF, MP2 and QCISD methods with a…”
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10
Estimating the π-bond energies and the stabilities of oxy-substituted carbocations
Published in Journal of molecular structure. Theochem (01-06-2007)“…Hydroxy-substituted methyl cations CH n ( OH ) 3 - n + , n = 1–3 have been studied with the B3LYP/6-31G ∗ and G3B3 levels of theory. Their relative stabilities…”
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