New perspectives on polyhedral molecules and their crystal structures

被引:10
作者
Alvarez, Santiago [1 ,2 ]
Echeverria, Jorge [1 ,2 ]
机构
[1] Univ Barcelona, Dept Quim Inorgan, Barcelona 08028, Spain
[2] Univ Barcelona, Inst Quim Teor & Computac, E-08028 Barcelona, Spain
关键词
continuous shape measures; polyhedral molecules; polyhedranes; polyhedrenes; stereochemistry; CONTINUOUS SYMMETRY MEASURES; X-RAY; SMALL RINGS; HYDROCARBON; SHAPE; C-60; FULLERENE; MAPS;
D O I
10.1002/poc.1735
中图分类号
O62 [有机化学];
学科分类号
070303 ; 081704 ;
摘要
Relevant families of ideal polyhedra (Platonic, Archimedean, prisms, Johnson, and Fullerenes) are briefly summarized, and an overview of polyhedral alkanes and alkenes, existing or hypothetical, is presented. The assignment of a polyhedral shape to a specific compound with the help of continuous shape measures and derived tools is also briefly discussed, and application of shape analysis to cyclic molecules such as cyclobutane, cyclohexane, and cyclooctatetraene is presented to illustrate the usefulness of ideal polyhedra in the stereochemical description of non-polyhedral molecules. Finally, the presence of latent octahedral symmetry in icosahedral polyhedra is used to design new molecules with nested shells of the two supposedly incompatible symmetries, and to explain the cubic crystal structures of icosahedral molecules such as dodecahedrane and Buckminsterfullerene. Copyright (C) 2010 John Wiley & Sons, Ltd.
引用
收藏
页码:1080 / 1087
页数:8
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