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Updated: Jan 28, 2026

From Molecules to Materials: Engineering New Ionic Liquid Crystals Through Halogen Bonding
Published on: March 24, 2018
Encapsulation of an Ionic Bond in Fullerenes: What is the Difference?
Yiyun Wang1, Yingying Shi1, Xingting Fan1
1State Key Laboratory and Institute of Elemento-Organic Chemistry, Collaborative Innovation Center of Chemical Science and Engineering (Tianjin) , Nankai University Tianjin 300071 , China.
Abstract:
Endohedral metallofullerene ions containing an ionic bond of Lu-Cl were observed in a mass spectrum for the first time. A theoretical calculation has been performed on the example of LuCl@C90. The two most stable isomers are LuCl@ C2(99917)-C90 and LuCl@ C2(99914)-C90. Interestingly, both encaged Lu-Cl bonds have potential curves quite different from the Morse curve and have some energy-preferential directions relative to their outside carbon cages.
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