THE ABINITIO ENERGY DIFFERENCE FAVORING THE NONCLASSICAL OVER THE CLASSICAL STRUCTURE OF THE BICYCLO[2.1.1]HEXYL CATION - COMPARISON OF CALCULATED (IGLO) AND EXPERIMENTAL C-13 CHEMICAL-SHIFTS

被引：60

作者：

SCHLEYER, PV

LAIDIG, K

WIBERG, KB

SAUNDERS, M

SCHINDLER, M

机构：

[1] YALE UNIV,DEPT CHEM,NEW HAVEN,CT 06520

[2] RUHR UNIV BOCHUM,INST THEORET PHYS,D-4630 BOCHUM 1,FED REP GER

来源：

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY | 1988年 / 110卷 / 01期

关键词：

D O I：

10.1021/ja00209a054

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：300 / 301

页数：2

共 20 条

[1] DEGENERATE CARBOCATION REARRANGEMENTS [J].

AHLBERG, P ;

JONSALL, G ;

ENGDAHL, C .

ADVANCES IN PHYSICAL ORGANIC CHEMISTRY, 1983, 19 :223-379

[2]

BLANCHETTE MC, 1987, J AM CHEM SOC, V109, P1382

[3]

BROWN HC, 1977, J ORG CHEM, V94, P2360

[4] CORRELATION OF SOLVOLYSIS RATES + ESTIMATION OF RATE ENHANCEMENTS [J].

FOOTE, CS .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1964, 86 (09) :1853-+

[5]

Hehre W. J., 1986, AB INITIO MOL ORBITA

[6] NUCLEOPHILIC CAPTURE OF 2-BICYCLO[2.1.1]HEXYL CATIONS [J].

KIRMSE, W ;

ZELLMER, V ;

GOER, B .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1986, 108 (16) :4912-4917

[7]

KIRMSE W, 1987, ORG CHEM, V52, P515

[8] STABILIZATION ENERGY AND ION SIZE IN CARBOCATIONS IN THE GAS-PHASE [J].

LOSSING, FP ;

HOLMES, JL .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1984, 106 (23) :6917-6920

[9] HIGHLY STRAINED BICYCLIC SYSTEMS .12. SYNTHESIS AND SOLVOLYSIS OF 1,5,5-TRIMETHYLBICYCLO[2.1.1]HEX-2-YL P-TOLUENESULFONATE [J].

MEINWALD, J ;

SHELTON, JC ;

BUCHANAN, GL ;

COURTIN, A .

JOURNAL OF ORGANIC CHEMISTRY, 1968, 33 (01) :99-&

[10] HIGHLY STRAINED BICYCLIC SYSTEMS .8. NITROUS ACID DEAMINATION OF 5,5-DIMETHYLBICYCLO [2.1.1]HEXYL-2BETA-AMINE [J].

MEINWALD, J ;

GASSMAN, PG ;

HURST, JJ .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1962, 84 (19) :3722-&

← 1 2 →