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Synthesis and Crystal Structure of Ethoxyethyl 3-(2-chloro-5-pyridyl methylamino)-2-cyano-3-methylthio acrylate
Authors:LIU Xin  HUANG Run-Qiu  LI Zai-Guo  WANG Hong-Gen  YAO Xin-Kan
Abstract:The crystal of the title compound C15H18ClN3O3S(Mr=355.85) was prepared and determined by Xray single crystal diffraction. The crystal is triclinic, space group P1 (No.2) with parameters: a=7.820(2), b=9.296(2), c=12.992(3), =69.87(3), =84.40(3), =85.80(3), V=881.7(4)3, Z=2, Dx=1340g/cm3, (MoK)=0.3438mm-1, F(000)=186, the final R=0.069 and Rw=0.064 for 1382 observed reflections. The Xray data confirmed the Estereochemistry of the title compound and demonstrated the presence of an intramolecular hydrogen bonding. =
Keywords:crystal structure  PSII inhibitor  cyano acrylate containing p yridylmethylamino
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