LIBROS DEL AUTOR: prashanth jyothi

7 resultados para LIBROS DEL AUTOR: prashanth jyothi

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  • Badania obliczeniowe 5-(4-metoksyfenylo)-1,3,4-oksadiazolo-2-aminy
    Jyothi Prashanth / Konakanchi Ramaiah
    Zarejestrowano eksperymentalne widma FT-Raman i FT-IR, UV-Visible i fluorescencji 5-(4-metoksyfenylo)-1,3,4-oksadiazolo-2-aminy (MPODA). Za pomocą teorii funkcjonałów gęstości (DFT) określono parametry kwantowo-chemiczne, takie jak najbardziej zoptymalizowane parametry geometryczne, częstotliwości drgań, orbitale HOMO i LUMO z ich luką energetyczną, potencjał jonizacji (I), pow...
    Disponible

    65,55 €

  • Estudo computacional da 5-(4-metoxifenil)-1,3,4-oxadiazol-2-amina
    Jyothi Prashanth / Konakanchi Ramaiah
    Foram registados os espectros experimentais FT-Raman e FT-IR, UV-Visível e de fluorescência da 5-(4-metoxifenil)-1,3,4-oxadiazol-2-amina (MPODA). Utilizando a Teoria da Função da Densidade (DFT), foram determinados parâmetros químicos quânticos como os parâmetros geométricos mais optimizados, frequências vibracionais, orbitais HOMO e LUMO com o seu intervalo de energia, potenci...
    Disponible

    65,55 €

  • Rechnerische Untersuchung von 5-(4-Methoxyphenyl)-1,3,4-oxadiazol-2-amin
    Jyothi Prashanth / Konakanchi Ramaiah
    Das experimentelle FT-Raman- und FT-IR-, UV-Visuelle- und Fluoreszenzspektrum von 5-(4-Methoxyphenyl)-1,3,4-oxadiazol-2-amin (MPODA) wurde aufgezeichnet. Mit Hilfe der Dichtefunktionstheorie (DFT) wurden quantenchemische Parameter wie die am meisten optimierten geometrischen Parameter, Schwingungsfrequenzen, HOMO- und LUMO-Orbitale mit ihren Energielücken, das Ionisierungspoten...
    Disponible

    65,55 €

  • Etude computationnelle de la 5-(4-méthoxyphényl)-1,3,4-oxadiazol-2-amine
    Jyothi Prashanth / Konakanchi Ramaiah
    Le spectre expérimental FT-Raman et FT-IR, UV-Visible et de fluorescence de la 5-(4-méthoxyphényl)-1,3,4-oxadiazol-2-amine (MPODA) a été enregistré. En utilisant la théorie de la fonction de densité (DFT), les paramètres chimiques quantiques tels que les paramètres géométriques les plus optimisés, les fréquences vibratoires, les orbitales HOMO et LUMO avec leur écart énergétiqu...
    Disponible

    65,55 €

  • Studio computazionale della 5-(4-metossifenile)-1,3,4-ossadiazolo-2-ammina
    Jyothi Prashanth / Konakanchi Ramaiah
    È stato registrato lo spettro sperimentale FT-Raman e FT-IR, UV-Visibile e di fluorescenza della 5-(4-metossifenil)-1,3,4-ossadiazol-2-amina (MPODA). Utilizzando la teoria della funzione di densità (DFT) sono stati determinati parametri chimici quantistici come i parametri geometrici più ottimizzati, le frequenze vibrazionali, gli orbitali HOMO e LUMO con il loro gap energetico...
    Disponible

    65,55 €

  • Biologically Active 2-Aminonicotinadhyde and its Metal Complexes
    Hussain Basha N. / Konakanchi Ramaiah / Prashanth Jyothi
    In the book, a novel series of biologically active metal complexes was successfully synthesized and thoroughly characterized using various spectroscopic techniques. These compounds were designed with the aim of enhancing their potential pharmacological properties. In addition, experimental studies are compared to theoretical studies, such as density functional theory and dockin...
    Disponible

    120,87 €

  • Computational study of 5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-amine
    Jyothi Prashanth / Konakanchi Ramaiah
    The experimental FT-Raman and FT-IR, UV-Visible, and fluorescence spectrum of 5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-amine (MPODA) has been recorded. Using Density Function Theory (DFT) quantum chemical parameters like most optimized geometrical parameters, vibrational frequencies, HOMO and LUMO orbitals with their energy gap, Ionization potential (I), electron affinity (A), har...
    Disponible

    67,11 €