da Costa, Wanessa Almeida, 5Program of Post-Graduation in Natural Resources Engineering (PRODERNA/ITEC), Federal University of Para, Belém, Pará, Brazil

• Journal of the Serbian Chemical Society Vol. 84 No. 6 (2019) - Theoretical Chemistry
  Theoretical study via DFT for prediction of 13C and 1H NMR data of two diterpenoids derived from the root of Salvia grandifolia (Short communication)
  Abstract  PDF (2.356 kB)  Supplementary Material (1.89 MB)  Structures of compounds 1 and 2.  Correlation between the experimental and calculated chemical shifts of 13C (A) and 1H (B) of diterpene 1 and 13C (C) and 1H (D) of diterpene 2. Methods: B3LYP/cc-pVDZ (â– ) and B3PW91/DGDZVP (â–¡). The effect of the solvent, pyridine and chloroform to diterpe  COVER LETTER FOR THE JOURNAL OF THE SERBIAN CHEMICAL SOCIETY  CorrFig2  slika 2