(E,E)-a-(Methoxyimino)-2-[({1-[3-(trifluoromethyl)-phenyl]ethylideneamino)oxymethyl]benzeneacetic acid

被引:6
作者
Banerjee, K
Ligon, AP
Schürmann, M
Preut, H
Spiteller, M
机构
[1] Univ Dortmund, Inst Umweltforsch, D-44221 Dortmund, Germany
[2] Univ Dortmund, Fachbereich Chem, D-44221 Dortmund, Germany
来源
ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS | 2005年 / 61卷
关键词
D O I
10.1107/S1600536805012900
中图分类号
O7 [晶体学];
学科分类号
0702 ; 070205 ; 0703 ; 080501 ;
摘要
The crystal structure of the title compound, C-19(17)3(2)4(3)H(F)N(O), a metabolite of the fungicide trifloxystrobin (TFS), contains one molecule in the asymmetric unit. The CF group is disordered over two positions. The important characteristics of the molecule are the two C=N bonds in an E, E configuration, one in the b-methoxy system and the other in the oxymethyl side chain between the two aromatic rings. The molecules are linked via an O - H N hydrogen bond and an infinite spiral is formed along the b-axis direction.
引用
收藏
页码:O1528 / O1529
页数:2
相关论文
共 7 条
  • [1] Ebeling M., 2003, Pflanzenschutz-Nachrichten Bayer, V56, P231
  • [2] Nardelli M., 1995, J APPL CRYSTALLOGR, V28, P659, DOI [10.1107/S0021889895007138, DOI 10.1107/S0021889895007138]
  • [3] Nonius, 1998, COLLECT
  • [4] Processing of X-ray diffraction data collected in oscillation mode
    Otwinowski, Z
    Minor, W
    [J]. MACROMOLECULAR CRYSTALLOGRAPHY, PT A, 1997, 276 : 307 - 326
  • [5] Sheldrick G. M., 1997, SHELXS 97 PROGRAM CR
  • [6] PHASE ANNEALING IN SHELX-90 - DIRECT METHODS FOR LARGER STRUCTURES
    SHELDRICK, GM
    [J]. ACTA CRYSTALLOGRAPHICA SECTION A, 1990, 46 : 467 - 473
  • [7] Single-crystal structure validation with the program PLATON
    Spek, AL
    [J]. JOURNAL OF APPLIED CRYSTALLOGRAPHY, 2003, 36 : 7 - 13