Influence of the basis set on the calculation of the absolute 13C shieldings of methyl derivatives (CH3X with X = CH3, CN, NH2, NO2, OH, F) with special emphasis in the cases of X = Cl, Br, SH, SeH, and PH2

Author： Alkorta Ibon   Elguero José  

Publisher： Springer Publishing Company

ISSN： 1040-0400

Source： Structural Chemistry, Vol.21, Iss.4, 2010-08, pp. : 755-759

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