EFFECT OF INTRAMOLECULAR INTERACTION ON MOLECULE CONFORMATION STABILITY AND CRYSTAL PACKING OF POLYNITROCOMPOUNDS

作     者：Atovmyan L O Golovina N I Institute of Chemical Physics,Russian Academy of Sciences 

出 版 物：《含能材料》 (Chinese Journal of Energetic Materials)

年 卷 期：1993年第3期

页      面：5-18页

核心收录：

主　　题：intramolecular interaction polynitrocompounds crystal packing 

摘      要：In study of polynitrocompounds it is found that a dense crystal mustnot necessarily be constructed from dense molecules,and the main factors affecting thecrystal structure are the electronic structure of their *** correlation betweenthe value of non-bonded intramolecular contact and the magnitude of the respective inter-molecular contact seems to be unusual for this kind of ***-N-oxide and 1, 1, 4, 4,-tetranitrobutanediol-2,3 derivatives weretaken as examples in this *** obtained results concluded that the intramolecularinteraction can stabilize the crystal conformation,while the increase in the intermolecularcontact decreases the crystal density.