当前位置: X-MOL 学术Angew. Chem. Int. Ed. › 论文详情
Our official English website, www.x-mol.net, welcomes your feedback! (Note: you will need to create a separate account there.)
Intramolecular π–π Interactions in Flexibly Linked Partially Fluorinated Bisarenes in the Gas Phase
Angewandte Chemie International Edition ( IF 16.6 ) Pub Date : 2017-09-19 08:10:41 , DOI: 10.1002/anie.201707716
Sebastian Blomeyer 1 , Marvin Linnemannstöns 1 , Jan Hendrick Nissen 1 , Jannik Paulus 1 , Beate Neumann 1 , Hans-Georg Stammler 1 , Norbert W. Mitzel 1
Affiliation  

Undistorted structures of compounds with C6H6 and C6F6 groups linked by (CH2)3 and (CH2)2SiMe2 moieties show folding by intramolecular dispersion forces in the gas phase whereas in the solid state, extended conformers are adopted that interact intermolecularly. The experimental data served as a reference for the quality of quantum-chemical calculations.

中文翻译:

气相中柔性连接的部分氟化双芳烃中的分子内π-π相互作用

由(CH 23和(CH 22 SiMe 2部分连接的具有C 6 H 6和C 6 F 6基团的化合物的未扭曲结构在气相中通过分子内分散力折叠,而在固态下,扩展的构象异构体为采用了分子间相互作用。实验数据为量子化学计算的质量提供了参考。
更新日期:2017-09-19
down
wechat
bug