Full-dimensional Molecular Dynamics Simulation of Electronic Absorption Spectra of Ethyl 1,4-Dihydro-4-Oxoquinoline-3-Carboxylate and its 6-Fluoro and 8-Nitro Derivatives in Dimethyl Sulfoxide

Jan Rimarcik; Kraiwan Punyain; Vladimir Lukes; Erik Klein; Anne-Marie Kelterer; Viktor Milata; Vlasta Brezova

Full-dimensional Molecular Dynamics Simulation of Electronic Absorption Spectra of Ethyl 1,4-Dihydro-4-Oxoquinoline-3-Carboxylate and its 6-Fluoro and 8-Nitro Derivatives in Dimethyl Sulfoxide

Jan Rimarcik, Kraiwan Punyain, Vladimir Lukes, Erik Klein, Anne-Marie Kelterer, Viktor Milata, Vlasta Brezova

Institute of Physical and Theoretical Chemistry (6350)

Research output: Contribution to journal › Article

Original language	English
Pages (from-to)	20-29
Journal	Acta chimica slovaca
Volume	3
Issue number	2
Publication status	Published - 2010

Treatment code (Nähere Zuordnung)

Basic - Fundamental (Grundlagenforschung)
Theoretical

Access to Document

http://www.acs.chtf.stuba.sk/?id=7&paper=65

Cite this

Full-dimensional Molecular Dynamics Simulation of Electronic Absorption Spectra of Ethyl 1,4-Dihydro-4-Oxoquinoline-3-Carboxylate and its 6-Fluoro and 8-Nitro Derivatives in Dimethyl Sulfoxide. / Rimarcik, Jan; Punyain, Kraiwan; Lukes, Vladimir; Klein, Erik; Kelterer, Anne-Marie; Milata, Viktor; Brezova, Vlasta.

In: Acta chimica slovaca, Vol. 3, No. 2, 2010, p. 20-29.

Research output: Contribution to journal › Article

Rimarcik, Jan ; Punyain, Kraiwan ; Lukes, Vladimir ; Klein, Erik ; Kelterer, Anne-Marie ; Milata, Viktor ; Brezova, Vlasta. / Full-dimensional Molecular Dynamics Simulation of Electronic Absorption Spectra of Ethyl 1,4-Dihydro-4-Oxoquinoline-3-Carboxylate and its 6-Fluoro and 8-Nitro Derivatives in Dimethyl Sulfoxide. In: Acta chimica slovaca. 2010 ; Vol. 3, No. 2. pp. 20-29.

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AU - Rimarcik, Jan

AU - Punyain, Kraiwan

AU - Lukes, Vladimir

AU - Klein, Erik

AU - Kelterer, Anne-Marie

AU - Milata, Viktor

AU - Brezova, Vlasta

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