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浙江省教育厅科研计划(20050057)

作品数:2 被引量:48H指数:2
相关作者:潘富友杨健国李钧敏闫华林彩萍更多>>
相关机构:台州学院更多>>
发文基金:浙江省自然科学基金浙江省教育厅科研计划更多>>
相关领域:理学更多>>

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Cu-(Ⅱ)2′-(2-噻吩亚甲基)水杨酰腙Schiff碱配合物的合成、表征、晶体结构及抑菌活性研究被引量:44
2005年
In ethanol, the copper(II) complex with the 2′-(2-thienylidene)-h ydroxybenzoylhydrazide, Cu(C12H10N2O2S)2, was synthesized, and it′s structure was characterized by IR, UV and elemental analysis. The single crystal structure has been determined by X-ray diffraction analysis. The crystal belongs to monoclinic system, space group C2/c with cell constants, a=2.273 6(4) nm, b=0.592 12(9) nm, c=1.828 1(3) nm, β=109.735(5)°, V=2.316 4(7) nm3, Z=4, μ=1.164 mm-1, Dc=1.595 g·cm-3, F(000)=1 140, R=0.048 6, wR=0.101 6. In the compound copper(II) atom is four-coordinated with two nitrogen atoms from amide and two oxygen atoms from keto group. Their biological activities have been measused. The results show that the anti-bacterial activity of the coordination compound is much better that of the ligand. CCDC: 272938.
杨健国潘富友李钧敏
关键词:铜配合物晶体结构
2’-(3-苯氧基苯亚甲基)-2-羟基苯甲酰腙的合成、晶体结构及理论计算被引量:4
2007年
The title compound was synthesized by the reaction of 3-benzoxybenzaldehyde with 2-hydroxybenzoylhydrazine in ethanol and characterized by IR,UV,1H NMR spectra and elemental analysis.The single crystal structure was determined by X-ray diffraction analysis.The crystal belongs to Monoclinic system,space group Cc with cell constant,a=0.48217(11) nm,b=3.2212(7) nm,c=1.0992(3) nm,β=101.755(5).,V=1.6714(7) nm3,Z=4,μ=0.090mm-1,DC=1.321 g/cm3,F(000)=696.The crystal measurement showed that the molecule was not coplanar.The crystal structure involving in intermolecular and intermolecular hydrogen bonds was observed,and the intermolecular hydrogen bonds are linked along the c-axis direction to form a chain.The title molecule was calculated by quantum chemistry at the RHF/6-31G level,frontier orbitals electronic densities and charge distribution were discussed.
闫华杨健国林彩萍潘富友
关键词:晶体结构
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