|
|
Dr. Lalka Daskalova Laboratory of Structural Organic Analysis Institute of Organic
Chemistry Acad. G. Bonchev Str.,
Build. 9 Tel: +359 2 9606138 Fax: +359 2 8700225 e-mail: |
|
|
1975 Born in Sofia, Bulgaria.
1999 Master of Science in Organic Chemistry at the University of Chemical Technology and Metallurgy, Sofia.
2007 PhD at IOCCP, Bulgarian Academy of Sciences. Thesis: “Theoretical and IR spectral studies of molecules, anions and hydrogen bonded complexes containing carbonyl groups”, Scientific supervisors: Prof. I. Binev and Prof. J. Dimitrova.
2007 Research Associate at IOCCP.
Scientific Interests:
Theoretical organic chemistry;
Structural organic analysis;
Vibrational spectroscopy;
Chemistry and spectroscopy of pharmaceuticals;
Participation in Summer Schools and Conferences:
2002, 30 October - 3 November, 1st Humboldt Conference on Computational Chemistry, Veliko Turnovo, Bulgaria;
2004, 1st Winter Schools for Young Researchers, Gyulechitsa;
2004, September 1-5, 2nd Humboldt Conference on Computational Chemistry, Nessebar, Bulgaria;
2004, October, 5th National Conference on Chemistry, Sofia, Bulgaria;
2005, 2nd Winter Schools for Young Researchers, Gyulechitsa;
2006, April 3-7, Workshop
“European Youth Academic Spring 2006”, Sofia, Bulgaria;
Participation in Projects:
2003-2005, “Organic molecules, radicals, ions and hydrogen-bonded complexes: chemical, physical and theoretical studies”, granted by the Bulgarian National Science Fund, Contract Chemistry-1213.
2005-2008, “Organic molecules, radicals, ions and hydrogen-bonded complexes: chemical, physical and theoretical studies”, granted by the Bulgarian National Science Fund, Contract Chemistry-1510.
Selected Publications:
Binev, Y.I., Georgieva, M.K., Daskalova, L.I., Spectrochemical, ab initio and density functional studies on the conversion of 2-hydroxybenzonitrile (o-cyanophenol) into the oxyanion, Spectrochim. Acta A60 (2004) 2601-2610.
A. Velcheva, L. I. Daskalova, I. G. Binev. Solvent effects of nicotinamide: experimental and computational studies. Bul. Chemm. Comunications, 36 (2004) 230-235.
Dimitrova, Y., Daskalova, L.I., Theoretical study of structures and stability of the hydrogen-bonded complexes between 2-hydroxybenzonitrile (o-cyanophenol) and CO, J. Mol. Struct. Theochem. 756 (2005) 73-78.
Velcheva, E.A., Daskalova, L.I., The experimental and computational study on the IR spectra and structure of pyridine-3-carboxamide (nicotinamide)-d0 and -d2, J. Mol. Struct., 741 (2005) 85-92.
Е. А. Velcheva, K. V. Petrova, N. S. Antonova, L. I. Daskalova, M. K. Georgieva, O. I. Petrov – Experimental and computational studies on IR spectra and structure of N-(4-ethoxyphenyl)acetamide and its azanion. C. R. Acad. Bulg. Sci., 58(5) (2005) 567.
L. I. Daskalova, I. G. Binev, Computational and experimental studies on energies structures and IR spectra of tautomers and conformers of ascorbic acid (Vitamin C), its anion and dianion, Bulg. Chem. Comm., 37 (2005), 374
Daskalova, L.I., Binev, I., Computational study of energies and structures of 2,4,6-pyrimidinetrione and its anions, Int. J. Quant. Chem. 106 (2006) 1338-1345.
Dimitrova, Y., Daskalova, L.I., Solvent effects on vibrational spectra of hydrogen-bonded complexes of propanedinitrile (malononitrile) and dimethyl sulfoxide (DMSO): Ab initio and DFT studies, J. Mol. Struct. Theochem. 823 (2007) 65-73.
Dimitrova, Y., Daskalova, L.I., Comparative study of the hydrogen-bonded complexes of phenol and o-cyanophenol with CO. Ab initio and DFT approachs, Spectrochim. Acta A66 (2007) 467-473.
Daskalova, L.I., Velcheva, E.A., Binev, I.G., Changes in the IR spectra and structures of pyridine-3-carboxamides-d0 and -d2 caused by their conversion into azanions-d0 and -d1: Experimental and computational studies, J. Mol. Struct. 826 (2007) 198-204.
Daskalova, L.I., Computational and experimental studies on the IR spectral and structural changes caused by the conversion of 5,5-diethyl(1H, 3H, 5H)-pyrimidinetrione into azanion and diazanion, J. Mol. Struct. Theochem. 848 (2008) 9-15.