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nmr spectra of azobenzene-bridged calix [8] arene complexes by ab initio hartree-fock calculations as nanostructure compound
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نویسنده
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sayadian masoumeh ,sadegh hamidreza ,ali gomaa abdelgawad mohammed
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منبع
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international journal of nano dimension - 2018 - دوره : 9 - شماره : 3 - صفحه:228 -237
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چکیده
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Calix[8]arenes of conformational rigid were isolated. the nmr parameters of the structure of calix[8]arenes have been compared. the study of organic structures to form nanoporous materials is wellk-nown in chemistry phenomena to find the crystal form of calix[8]arene as supramolecule. investigated and compared hydrogen bonding, oxygen and nitrogen atoms effect on calix[8]arene and its complexes were reported at hartree-fock (hf) theory by gaussian 2003 of program package. in this work, the complexing properties of azobenzene-bridged calix[8]arene with alkali earth metal cations has studied. the complexation properties of calix[8]arene were studied by hf method. the complex of the calixarenes showed different properties for the different cations, depending on the cations and the position of the substituent grafted on the ligand.
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کلیدواژه
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calix [8] arene ,chemical shift ,density functional theory ,hartree-fock ,hydrogen bonding ,nanostructure
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آدرس
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islamic azad university, islamshahr branch, department of chemistry, ایران, west pomeranian university of technology, faculty of chemical technology and engineering, division of functional materials and biomaterials, poland, al‒azhar university, faculty of science, chemistry department, egypt. university malaysia pahang, faculty of industrial sciences and technology, malaysia
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پست الکترونیکی
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gomaasanad@gmail.com
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Authors
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