THE LIPOPHILICALLY WRAPPED POLYION AGGREGATE (H120C144O24(OP)(2)N-NA6+), A HEXAMERIC SODIUM TETRAPHENYL IMIDODIPHOSPHATE CONTAINING AN [NA6O12] CORE IN A HYDROCARBON ELLIPSOID

被引:30
作者
BOCK, H
SCHODEL, H
HAVLAS, Z
HERRMANN, E
机构
[1] ACAD SCI CZECH REPUBL,INST ORGAN CHEM & BIOCHEM,PRAGUE,CZECH REPUBLIC
[2] HSCH TECHN & WIRTSCHAFT,D-01069 DRESDEN,GERMANY
来源
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION IN ENGLISH | 1995年 / 34卷 / 12期
关键词
POLYION AGGREGATES; SODIUM COMPOUNDS; STRUCTURE ELUCIDATION;
D O I
10.1002/anie.199513551
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
An amazingly simple access by dissolving barium metal in tBuOH, addition of nBuLi, and crystallization from THF/hexane leads to the polyion aggregate 1. The novel polyhedral Ba6Li3O2 core has a charge of 11+ and is surrounded by an ellipsoidal C56H123 hydrocarbon skin. Density functional calculations for a 33‐center/460‐electron model revealed that it is indeed a polyion aggregate, and that weak interactions exist between the two oxygen centers in the polyhedron. In the second communication the hydrocarbon ellipsoid of the polyion aggregate consists of 24 phenyl groups, and the interactions between them are analyzed. (Figure Presented.) Copyright © 1995 by VCH Verlagsgesellschaft mbH, Germany
引用
收藏
页码:1355 / 1357
页数:3
相关论文
共 21 条
[1]  
BECK R, 1995, THESIS U FRANKFURT
[2]   GENERATION OF UNKNOWN CRYSTAL PHASES FOR AROMATIC-HYDROCARBONS BY PACKING ENERGY CALCULATIONS [J].
BERNSTEIN, J ;
SARMA, JARP ;
GAVEZZOTTI, A .
CHEMICAL PHYSICS LETTERS, 1990, 174 (3-4) :361-368
[3]   THE LIPOPHILICALLY WRAPPED POLYION AGGREGATE ([BA6LI3O2](11+) [(OC)-O--(CH3)(3)](11)(OC4H8)(3)), A FACE-SHARING (OCTAHEDRON PLUS PRISMANE) BA6LI3O2 POLYHEDRON IN A HYDROCARBON ELLIPSOID - PREPARATION, SINGLE-CRYSTAL STRUCTURE-ANALYSIS, AND DENSITY-FUNCTIONAL CALCULATIONS [J].
BOCK, H ;
HAUCK, T ;
NATHER, C ;
ROSCH, N ;
STAUFER, M ;
HABERLEN, OD .
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION IN ENGLISH, 1995, 34 (12) :1353-1355
[4]  
BOCK H, 1995, ANGEW CHEM, V107, P1439
[5]  
BOCK H, 1995, IN PRESS J AM CHEM S, V117
[6]  
BOCK H, UNPUB J CHEM SOC CHE
[7]  
BOCK HE, UNPUB
[8]   AROMATIC-AROMATIC INTERACTION - A MECHANISM OF PROTEIN-STRUCTURE STABILIZATION [J].
BURLEY, SK ;
PETSKO, GA .
SCIENCE, 1985, 229 (4708) :23-28
[9]  
BURLEY SK, 1986, J AM CHEM SOC, V108, P7955
[10]  
HERRMANN E, 1979, Z CHEM, V19, P187