Synthesis and Crystal Structure of 3-{[（1E） 1-（2- Hydroxyphenyl） methylidene]amino}-4-cyanopyrazole.pdfVIP

28卷 1O期 结 构 化 学 (JIEGOUHUAXUE) 、，0l1．28． No．10 2009．10 Chinese J． Struct． Chem． 1281-1285 SynthesisandCrystalStructureof3·{【(1E)1一(2一 Hydroxypheny1)methylidene]amino}。4．cyanopyrazole① CHENGQing—Fang’ XUXing—You WANGQi—Fac OIANBao—Hua LIUWang—Jun0 YANGXu．Jie (MaterialsChemistryLaboratory,NanjingUniversity ofScienceandTechnology,Nanjing210094,China) 。(DepartmentofChemicalTechnology,Huaihai InstituteofTechnology,Lianyungang222005，China) 。(JiangsuKeyLaboratoryofMarineBiotechnology, HuaihaiInstituteofTechnology,Lianyungang222005，China) ABSTRACT ThetitleSchiffbasecompound(C11HsN40)，aderivativeofpyrazole，hasbeen synthesizedbythereactionofsalicylaldehydeand3一amino一4一cyanopyrazoleinabsoluteethanoland characterizedbyelementalanalyses，IR，H NMR andX—raysingle—crystaldiffraction．Thecrystal belongstothemonoclinicsystem，spacegroupP21／n，wihta=7．5594(7)，b=18．3342(19)，C= 22．461(2)A， =98．419(2)。，V=3079．5(5)A。，Mr=212．21，Z=12，F(O00)=1320，Dc=1．373 g／cm ，T=298(2)K， =0．71073A，thefinalR=0．0571andwR=0．0493．Atotalof5412unique reflectionswerecollected．ofwhich1612withI20{／)wereobserved．Themoleculra structure adoptsatransconfigurationabouttheC=N doublebond．Thepreliminarybiologicaltestsshow that htecompoundhashighna tibacterialactivities． Keywords：Schiffbase，pyrazolederivative，crystalstructure，antibacterialactivities 1 INTRoDUCTIoN aminopyrazoleandaromaticaldehydehasnotbeen