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The interaction of β-cyclodextrin with benzoic acid

✍ Scribed by L. A. Belyakova; A. M. Varvarin; O. V. Khora; E. I. Oranskaya


Book ID
110183978
Publisher
International Academic Publishing Co (Nauka/Interperiodica)
Year
2008
Tongue
English
Weight
229 KB
Volume
82
Category
Article
ISSN
0036-0244

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Theoretical studies of inclusion complex
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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