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Theoretical study of inclusion complexation of 3-amino-5-nitrobenzisothiazole with β-cyclodextrin

✍ Scribed by Nouar Leila; Haiahem Sakina; Abdelaziz Bouhadiba; Fatiha Madi

Publisher
Elsevier Science
Year
2011
Tongue
English
Weight
982 KB
Volume
160
Category
Article
ISSN
0167-7322

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✍ Ming-Ju Huang; John D. Watts; Nicholas Bodor 📂 Article 📅 1997 🏛 John Wiley and Sons 🌐 English ⚖ 175 KB 👁 1 views

AM1 semiempirical molecular orbital calculations have been performed Ž . on the inclusion complexes of ␤-cyclodextrin ␤-CD with methylated benzoic acids in two orientations, the ''head-first'' and ''tail-first'' positions. In the former, the CO H 2 group points toward the primary hydroxyls of the CD