2,5-Bis(methylthio)-1,4-benzoquinone and 2-methyl-3-(methylsulfonyl)benzo[b]thiophene

被引:0
作者
Parvez, M [1 ]
Mesher, ST [1 ]
Clark, PD [1 ]
机构
[1] Univ Calgary, Dept Chem, Calgary, AB T2N 1N4, Canada
关键词
D O I
暂无
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
The structure of 2,5-bis(methylthio)-1,4-benzoquinone, C8H8O2S2, is composed of an essentially planar centrosymmetric benzoquinone substituted with two methylthio groups. The important bond distances are S-Csp(3) 1.788 (2) and S-Csp(2) 1.724 (2) Angstrom, and the two Csp(2)-Csp(2) distances are 1.447 (3) and 1.504 (3) Angstrom, which differ significantly. There are short S ... S interactions of 3.430 (1) Angstrom and Csp(2)-H ... O-type contacts forming a dimeric motif with graph set R-2(2)(8). The structure of 2-methyl-3-(methylsulfonyl)benzo[b]thiophene, C10H10O2S2, is composed of an essentially planar benzothiophene moiety substituted with methyl and methylsulfonyl groups. The mean values of the important bond distances are endocyclic S-Csp(2) 1.734 (3), S=O 1.434 (4) and C-C-aromatic 1.389 (10) Angstrom. The exocyclic S-Csp(2) and S-Csp(3) distances are 1.759 (4) and 1.763 (5) Angstrom, respectively.
引用
收藏
页码:574 / 576
页数:3
相关论文
共 13 条
  • [1] UNEXPECTED THERMAL EXTRUSION OF CO2 FROM 3-BENZYLTHIAZOLIDIN-2-ONE 1,1-DIOXIDES TO GIVE 2-PHENYLTHIAZOLINES AND THIAZOLES
    AITKEN, RA
    ARMSTRONG, DP
    MESHER, STE
    [J]. TETRAHEDRON LETTERS, 1994, 35 (33) : 6143 - 6146
  • [2] ALLEN FH, 1993, CHEM DESIGN AUTOMATI, V8, P131
  • [3] [Anonymous], STRUCTURE CORRELATIO
  • [4] Clay-catalyzed thioalkylation of thiophenes and benzo[b]thiophenes
    Clark, PD
    Mesher, STE
    Primak, A
    [J]. PHOSPHORUS SULFUR AND SILICON AND THE RELATED ELEMENTS, 1996, 114 (1-4): : 99 - 108
  • [5] Enraf-Nonius, 1989, CAD 4 SOFTW VERS 5 0
  • [6] FAN HF, 1991, SAPI91
  • [7] ON ENANTIOMORPH-POLARITY ESTIMATION
    FLACK, HD
    [J]. ACTA CRYSTALLOGRAPHICA SECTION A, 1983, 39 (NOV): : 876 - 881
  • [8] HU Y, 1998, POLYM PREPR, V39, P519
  • [9] Johnson C. K., 1976, ORNL5138
  • [10] *MOL STRUCT CORP, 1988, MSC AFC DIFFR CONTR