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The Journal of Physical Chemistry. A|April 10, 2012
Substituent effects on the thermochemistry of thiophenes. a theoretical (G3(MP2)//B3LYP and G3) studyRafael Notario, Manuel Temprado, María Victoria Roux, et al.
The Journal of Physical Chemistry. A|September 26, 2008
Thermochemistry of 2- and 3-thiopheneacetic acids: calorimetric and computational studyManuel Temprado, María Victoria Roux, Pilar Jiménez, et al.
The Journal of Physical Chemistry. A|June 16, 2006
Computational study of 1,3-dithiane 1,1-dioxide (1,3-dithiane sulfone). Description of the inversion process and manifestation of stereoelectronic effects on 1JC-H coupling constantsRafael Notario, María Victoria Roux, Gabriel Cuevas, et al.
The Journal of Organic Chemistry|February 28, 2004
Calorimetric and computational study of 1,3-dithiacyclohexane 1,1-dioxide (1,3-dithiane sulfone)María Victoria Roux, Manuel Temprado, Pilar Jiménez, et al.
The Journal of Organic Chemistry|March 25, 2006
Calorimetric and computational study of 1,4-dithiacyclohexane 1,1-dioxide (1,4-dithiane sulfone)María Victoria Roux, Manuel Temprado, Pilar Jiménez, et al.
The Journal of Organic Chemistry|February 10, 2007
Calorimetric and computational study of 1,3- and 1,4-oxathiane sulfonesMaría Victoria Roux, Manuel Temprado, Pilar Jiménez, et al.
The Journal of Physical Chemistry. A|July 24, 2008
Structure-energy relationship in barbituric acid: a calorimetric, computational, and crystallographic studyMaría Victoria Roux, Manuel Temprado, Rafael Notario, et al.
The Journal of Organic Chemistry|March 1, 2003
Calorimetric and computational study of thiacyclohexane 1-oxide and thiacyclohexane 1,1-dioxide (thiane sulfoxide and thiane sulfone). Enthalpies of formation and the energy of the S=O bondMaría Victoria Roux, Manuel Temprado, Pilar Jiménez, et al.
The Journal of Physical Chemistry. A|March 25, 2011
Experimental and computational thermochemical study of barbituric acids: structure-energy relationship in 1,3-dimethylbarbituric acidMaría Victoria Roux, Rafael Notario, Concepción Foces-Foces, et al.
The Journal of Organic Chemistry|February 16, 2002
Intrinsic (gas phase) thermodynamic stability of 2-adamantyl cation. Its bearing on the solvolysis rates of 2-adamantyl derivativesJosé-Luis M Abboud, Obis Castaño, Juan Z Dávalos, et al.
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