THE C9H9+ POTENTIAL-ENERGY SURFACE STUDIED BY MINDO/3, MNDO, AND AB INITIO-SCF(STO-3G) CALCULATIONS

被引：16
作者：
HUANG, MB
GOSCINSKI, O
JONSALL, G
AHLBERG, P
机构：
[1] UNIV UPPSALA,DEPT ORGAN CHEM,S-75121 UPPSALA,SWEDEN
[2] UNIV UPPSALA,DEPT QUANTUM CHEM,S-75120 UPPSALA,SWEDEN
来源：
JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2 | 1983年 / 03期
关键词：
D O I：
10.1039/p29830000305
中图分类号：
O62 [有机化学];
学科分类号：
070303 ; 081704 ;
摘要：
引用
收藏
页码：305 / 309
页数：5
相关论文
共 32 条
[1]  
AHLBERG P, 1972, CHEM SCRIPTA, V2, P231
[2]   BISHOMOTROPYLIUM IONS UNDER CONDITIONS OF LONG AND SHORT LIFE [J].
AHLBERG, P ;
SEIDL, P ;
SAKAI, M ;
WARNER, P ;
WINSTEIN, S ;
COOK, D ;
ROBERTS, M ;
HAMBERGE.H ;
HARRIS, DL ;
DIRLAM, JP ;
DIAZ, A .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1972, 94 (20) :7063-&
[3]   DIRECT OBSERVATION OF TOTALLY DEGENERATE 9-BARBARALYL CATION AND BICYCLO 4.3.0!NONATRIENYL CATION, A 1,4-BISHOMOTROPYLIUM ION [J].
AHLBERG, P ;
HARRIS, DL ;
WINSTEIN, HS .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1970, 92 (14) :4454-&
[4]   THE 9-BARBARALYL CATION - ISOTOPIC PERTURBATION BY 8 DEUTERIUMS OF A TOTALLY DEGENERATE C-13-LABELED C9H9+ CARBONIUM-ION [J].
AHLBERG, P ;
ENGDAHL, C ;
JONSALL, G .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1981, 103 (06) :1583-1584
[5]  
AHLBERG P, 1982, ADV PHYS ORG CHEM, V19, P223
[6]   DEGENERACY IN BICYCLONONATRIENYL-BARBARALYL CATION REATTANGEMENT .4. [J].
BARBORAK, JC ;
SCHLEYER, PV .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1970, 92 (10) :3184-&
[7]   DEGENERATE REARRANGEMENTS OF 9-BARBARALYL CATION [J].
BARBORAK, JC ;
DAUB, J ;
FOLLWEIL.DM ;
SCHLEYER, PV .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1969, 91 (27) :7760-&
[8]   GROUND-STATES OF MOLECULES .27. MINDO-3 CALCULATIONS FOR CHON SPECIES [J].
BINGHAM, RC ;
DEWAR, MJS ;
LO, DH .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (06) :1302-1306
[9]   GROUND-STATES OF MOLECULES .28. MINDO-3 CALCULATIONS FOR COMPOUNDS CONTAINING CARBON, HYDROGEN, FLUORINE, AND CHLORINE [J].
BINGHAM, RC ;
DEWAR, MJS ;
LO, DH .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (06) :1307-1311
[10]   GROUND-STATES OF MOLECULES .26. MINDO-3 CALCULATIONS FOR HYDROCARBONS [J].
BINGHAM, RC ;
DEWAR, MJS ;
LO, DH .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (06) :1294-1301
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