مرکز اطلاعات علمی Scientific Information Database (SID) - Trusted Source for Research and Academic Resources

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Information Journal Paper

Title

SOLVENT EFFECT ON THE MOLECULAR STRUCTURE, CHEMICAL REACTIVITY AND SPECTROSCOPY PROPERTIES OF Z-LIGUSTILIDE: A MAIN ACTIVE COMPONENT OF MULTITUDE UMBELLIFERAE MEDICINAL PLANTS

Pages

  28-45

Keywords

1H AND 13C NMR CALCULATIONS 

Abstract

 In this investigation, the structural, electronic properties, 13C and 1H NMR parameters and first hyperpolarizability of Z-LIGUSTILIDE were explored. As well, the solvent effect on structural parameters, frontier orbital energies, electronic transitions, and 13C and 1H NMR parameters was illustrated based on Polarizable Continuum Model (PCM).These consequences specify that the polarity of solvents participates on the structures and spectroscopic properties of Z-LIGUSTILIDE. NBO ANALYSIS was used to examining of the hybridation of atoms, atomic charges and their second order stabilization energy within the molecule.

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  • Cite

    APA: Copy

    OSANLOO, MAHMOUD, & GHIASI, REZA. (2017). SOLVENT EFFECT ON THE MOLECULAR STRUCTURE, CHEMICAL REACTIVITY AND SPECTROSCOPY PROPERTIES OF Z-LIGUSTILIDE: A MAIN ACTIVE COMPONENT OF MULTITUDE UMBELLIFERAE MEDICINAL PLANTS. JOURNAL OF APPLIED CHEMICAL RESEARCH (JACR), 11(3), 28-45. SID. https://sid.ir/paper/323085/en

    Vancouver: Copy

    OSANLOO MAHMOUD, GHIASI REZA. SOLVENT EFFECT ON THE MOLECULAR STRUCTURE, CHEMICAL REACTIVITY AND SPECTROSCOPY PROPERTIES OF Z-LIGUSTILIDE: A MAIN ACTIVE COMPONENT OF MULTITUDE UMBELLIFERAE MEDICINAL PLANTS. JOURNAL OF APPLIED CHEMICAL RESEARCH (JACR)[Internet]. 2017;11(3):28-45. Available from: https://sid.ir/paper/323085/en

    IEEE: Copy

    MAHMOUD OSANLOO, and REZA GHIASI, “SOLVENT EFFECT ON THE MOLECULAR STRUCTURE, CHEMICAL REACTIVITY AND SPECTROSCOPY PROPERTIES OF Z-LIGUSTILIDE: A MAIN ACTIVE COMPONENT OF MULTITUDE UMBELLIFERAE MEDICINAL PLANTS,” JOURNAL OF APPLIED CHEMICAL RESEARCH (JACR), vol. 11, no. 3, pp. 28–45, 2017, [Online]. Available: https://sid.ir/paper/323085/en

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