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DFT calculations of structure and vibrational properties of 2,2,2-trichloroethylacetate, CH(3)CO(2)CH(2)CCl(3)

Diego M Gil1, María E Tuttolomondo1, Aída Ben Altabef1

  • 1INQUINOA, CONICET, Instituto de Química Física, Facultad de Bioquímica, Química y Farmacia, Universidad Nacional de Tucumán, San Lorenzo 456, T4000CAN Tucumán, Argentina.

Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|January 11, 2014
PubMed

Keywords:
2,2,2-TrichloroethylacetateAb initio calculationsDFT calculationsInfrared and Raman spectroscopy

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