METHYLNITRENE - THEORETICAL PREDICTIONS OF ITS MOLECULAR-STRUCTURE AND COMPARISON WITH THE CONVENTIONAL C-N SINGLE BOND IN METHYLAMINE

被引:24
作者
XIE, YM [1 ]
SCUSERIA, GE [1 ]
YATES, BF [1 ]
YAMAGUCHI, Y [1 ]
SCHAEFER, HF [1 ]
机构
[1] UNIV GEORGIA,SCH CHEM SCI,CTR COMPUTAT QUANTUM CHEM,ATHENS,GA 30602
关键词
D O I
10.1021/ja00196a026
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
引用
收藏
页码:5181 / 5185
页数:5
相关论文
共 34 条
[1]   ARE AROYLNITRENES GROUND-STATE SINGLETS - PHOTOCHEMISTRY OF BETA-NAPHTHOYL AZIDE [J].
AUTREY, T ;
SCHUSTER, GB .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1987, 109 (19) :5814-5820
[2]   ELECTRONIC SPLITTING BETWEEN 2B1 AND 2A1 STATES OF NH2 RADICAL [J].
BENDER, CF ;
SCHAEFER, HF .
JOURNAL OF CHEMICAL PHYSICS, 1971, 55 (10) :4798-&
[3]  
Berry R. S., 1970, NITRENES, P13
[5]  
CAREY FA, 1977, ADV ORGANIC CHEM B, P301
[6]   THE STRUCTURE OF THE METHYLNITRENE RADICAL [J].
CARRICK, PG ;
BRAZIER, CR ;
BERNATH, PF ;
ENGELKING, PC .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1987, 109 (17) :5100-5102
[7]  
CARRICK PG, 1984, J CHEM PHYS, V81, P1667
[8]   METHYLNITRENE FREE-RADICAL - GROUND-STATE VIBRATIONAL FUNDAMENTALS AND HARMONIC FORCE-FIELD FROM JET-COOLED EMISSION-SPECTRA OF THE A-APPROXIMATELY-3E-X-APPROXIMATELY-3A2 BAND SYSTEM [J].
CHAPPELL, EL ;
ENGELKING, PC .
JOURNAL OF CHEMICAL PHYSICS, 1988, 89 (10) :6007-6026
[9]   TRIPLET METHYLNITRENE - AN INDEFINITELY STABLE SPECIES IN THE ABSENCE OF COLLISIONS [J].
DEMUYNCK, J ;
FOX, DJ ;
YAMAGUCHI, Y ;
SCHAEFER, HF .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1980, 102 (20) :6204-6207