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Lauro Figueroa-Valverde, Francisco Díaz-Cedillo, Elodia Garcia-Cervera, "Synthesis of Two Steroids Derivatives and its Relationship with some Physicochemical Parameters", Journal of Chemistry, vol. 9, Article ID 481769, 8 pages, 2012. https://doi.org/10.1155/2012/481769
Synthesis of Two Steroids Derivatives and its Relationship with some Physicochemical Parameters
Abstract
Two danazol derivatives were synthesized and characterized by spectral analyses. In order to characterize the structural and physicochemical requirements of danazol derivatives, several parameters such HOMO-LUMO gap, ΔHf, RMSg, dipole moment (µ) and bond length were evaluated. The results showed that HOMO and µ was high in the compound 5 in comparison with the compound 3. In conclusion all these data indicate that increase in the length of chain induce greater moment dipole and increase HOMO gap in the compound 5 with respect to 3.
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Copyright © 2012 Hindawi Publishing Corporation. This is an open access article distributed under the Creative Commons Attribution License, which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited.
