THE B(1A')]-X(1A') SPECTRUM OF CIFCS

被引:5
作者
CLOUTHIER, DJ [1 ]
KNIGHT, AR [1 ]
STEER, RP [1 ]
JUDGE, RH [1 ]
MOULE, DC [1 ]
机构
[1] BROCK UNIV,DEPT CHEM,ST CATHARINES L2S 3A1,ONTARIO,CANADA
关键词
Chemical bonds - Ground state;
D O I
10.1016/0022-2852(80)90317-3
中图分类号
O64 [物理化学(理论化学)、化学物理学]; O56 [分子物理学、原子物理学];
学科分类号
070203 ; 070304 ; 081704 ; 1406 ;
摘要
The vibrational structure of the first strong electronic transition, B¯1A′ → X¯1A′, of CIFCS has been analyzed. Four excited state frequencies have been identified. The excited state is nonplanar and has a barrier to inversion of 5=2000 cm-1 and a C-S bond which is about 0.5 Å longer than the ground state. Copyright © 1980 by Academic Press, Inc.
引用
收藏
页码:148 / 160
页数:13
相关论文
共 32 条
[1]   LONG PATH LENGTH, LOW-TEMPERATURE MULTIPLE TRAVERSAL CELL [J].
BIERNACKI, A ;
MOULE, DC ;
NEALE, JL .
APPLIED SPECTROSCOPY, 1972, 26 (06) :648-+
[2]   THE ELECTRONIC SPECTRUM OF FORMALDEHYDE [J].
BRAND, JCD .
JOURNAL OF THE CHEMICAL SOCIETY, 1956, (APR) :858-872
[3]  
BRAND JCD, 1965, T FARADAY SOC, V61, P2356
[4]   NON-EMPIRICAL SCF AND CI STUDY OF GROUND AND EXCITED-STATES OF THIOFORMALDEHYDE [J].
BRUNA, PJ ;
PEYERIMHOFF, SD ;
BUENKER, RJ .
CHEMICAL PHYSICS, 1974, 3 (01) :35-53
[5]   THEORETICAL PREDICTION OF ELECTRONIC-SPECTRUM OF THIOACETONE AND COMPARISON WITH RELATED SYSTEMS [J].
BRUNA, PJ ;
BUENKER, RJ ;
PEYERIMHOFF, SD .
CHEMICAL PHYSICS, 1977, 22 (03) :375-382
[6]  
BURNELLE L, 1958, ACAD ROY BELG SM, V30, P2
[7]   ELECTRONIC RELAXATION AS A CAUSE OF DIFFUSENESS IN ELECTRONIC SPECTRA [J].
BYRNE, JP ;
ROSS, IG .
AUSTRALIAN JOURNAL OF CHEMISTRY, 1971, 24 (06) :1107-+
[8]  
Clark CHD, 1934, PHILOS MAG, V18, P459
[9]   2ND EXCITED SINGLET-STATE EMISSION-SPECTROSCOPY OF THIOCARBONYLS .2. THIOCARBONYL CHLOROFLUORIDE [J].
CLOUTHIER, DJ ;
KNIGHT, AR ;
STEER, RP ;
HACKETT, PA .
CHEMICAL PHYSICS, 1980, 48 (01) :13-20
[10]   2ND EXCITED SINGLET-STATE FLUORESCENCE OF CIFCS [J].
CLOUTHIER, DJ ;
KNIGHT, AR ;
STEER, RP .
CHEMICAL PHYSICS LETTERS, 1978, 59 (01) :62-65