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Complexation of Calix[4]arene With Alkali Metal Cations: Conformational Binding Selectivity and Cation-π Driven Inclusion

✍ Scribed by Bernardino, R.J.; Costa Cabral, B.J.

Book ID
120329022
Publisher
Taylor and Francis Group
Year
2002
Tongue
English
Weight
351 KB
Volume
14
Category
Article
ISSN
1061-0278

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Density functional theory study of calix
Density functional theory study of calix[4]arene-N-azacrown-5, calix[4]arene-N-phenyl-azacrown-5, and their complexes with alkali-metal cations: Na+, K+, and Rb+
✍ Xiaoyan Zheng; Xueye Wang; Shanfeng Yi; Nuanqing Wang; Yueming Peng 📂 Article 📅 2009 🏛 John Wiley and Sons 🌐 English ⚖ 473 KB

## Abstract Theoretical studies of 1,3‐alternate‐25,27‐bis(1‐methoxyethyl)calix[4]arene‐azacrown‐5 (**L~1~**), 1,3‐alternate‐25,27‐bis(1‐methoxyethyl)calix[4]arene‐__N__‐phenyl‐azacrown‐5 (**L~2~**), and the corresponding complexes M^+^/ **L** of **L~1~** and **L~2~** with the alkali‐metal cations: