Do localized structures of [14]- and [18]annulenes exist?

被引:33
作者
Choi, CH
Kertesz, M
Karpfen, A
机构
[1] GEORGETOWN UNIV,DEPT CHEM,WASHINGTON,DC 20057
[2] UNIV VIENNA,INST THEORET CHEM & RADIAT CHEM,A-1090 VIENNA,AUSTRIA
关键词
D O I
10.1021/ja971035a
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
[No abstract available]
引用
收藏
页码:11994 / 11995
页数:2
相关论文
共 39 条
[1]   CALCULATION OF STRUCTURES OF HYDROCARBONS CONTAINING DELOCALIZED ELECTRONIC SYSTEMS BY MOLECULAR MECHANICS METHOD [J].
ALLINGER, NL ;
SPRAGUE, JT .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1973, 95 (12) :3893-3907
[2]   Ab initio density functional vs Hartree Fock predictions for the structure of [18]annulene: Evidence for bond localization and diminished ring currents in bicycloannelated [18]annulenes [J].
Baldridge, KK ;
Siegel, JS .
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION IN ENGLISH, 1997, 36 (07) :745-748
[3]   THE LOW-TEMPERATURE UV/VIS ABSORPTION-SPECTRUM OF [14]ANNULENE [J].
BAUMANN, H ;
OTH, JFM .
HELVETICA CHIMICA ACTA, 1995, 78 (03) :679-692
[5]   DENSITY-FUNCTIONAL THERMOCHEMISTRY .3. THE ROLE OF EXACT EXCHANGE [J].
BECKE, AD .
JOURNAL OF CHEMICAL PHYSICS, 1993, 98 (07) :5648-5652
[6]   DENSITY-FUNCTIONAL EXCHANGE-ENERGY APPROXIMATION WITH CORRECT ASYMPTOTIC-BEHAVIOR [J].
BECKE, AD .
PHYSICAL REVIEW A, 1988, 38 (06) :3098-3100
[7]   CRYSTAL STRUCTURE OF (18)ANNULENE .I. X-RAY STUDY [J].
BREGMAN, J ;
HIRSHFELD, FL ;
RABINOVICH, D ;
SCHMIDT, GMJ .
ACTA CRYSTALLOGRAPHICA, 1965, 19 :227-+
[8]   Bond alternation of polyacetylene as a spin-Peierls distortion [J].
Capponi, S ;
Guihery, N ;
Malrieu, JP ;
Miguel, B ;
Poilblanc, D .
CHEMICAL PHYSICS LETTERS, 1996, 255 (4-6) :238-243
[9]   CRYSTAL AND MOLECULAR STRUCTURE OF [14] ANNULENE [J].
CHIANG, CC ;
PAUL, IC .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1972, 94 (13) :4741-&
[10]  
CHOI CH, IN PRESS J CHEM PHYS