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首页> 外文期刊>European Journal of Chemistry >Synthesis, structural elucidation and X-ray crystallographic studies of 1-(3,5-bis(trifluoromethyl]phenyl)-3-(dimethylamino)prop-2-en-l-one
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Synthesis, structural elucidation and X-ray crystallographic studies of 1-(3,5-bis(trifluoromethyl]phenyl)-3-(dimethylamino)prop-2-en-l-one

机译:1-(3,5-双(三氟甲基]苯基)-3-(二甲基氨基)PR-2-en-L-1的合成,结构阐明和X射线晶体研究

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摘要

A new enaminone was synthesized by reacting 3,5-bis-[trifluoromethyl)acetophenones and N,N-dimethylformamide dimethyl acetal and its detailed structural and crystalline properties were studied. The crystal data were found to be as C13H11F6NO, monoclinic, space group P21/c (no. 14), a = 8.1556(8) A,b = 24.877(3) A, c = 7.6067(7) A, B = 116.745(6)°, V= 1378.2(3) A3, Z= 4, T= 293(2) K, u(MoKa) = 0.150 mmi, Dcalc= 1.500 g/cm3, 40777 reflections measured (5.594° < 26 < 56.786°), 3413 unique (Rint = 0.1040, Rsigma = 0.0584) which were used in all calculations. The final Ri was 0.0771 (I >2cr(I)) and wR2 was 0.2541 (all data).
机译:通过反应3,5-双甲基)苯乙酮和N,N-二甲基甲酰胺二甲基缩醛和其详细的结构和结晶性能来合成新的烯喃酮。 发现晶体数据是C13H11F6NO,单岩,空间组P21 / C(NO.14),A = 8.1556(8)A,B = 24.877(3)A,C = 7.6067(7)A,B = 116.745 (6)°,v = 1378.2(3)A3,Z = 4,T = 293(2)k,U(Moka)= 0.150mmi,Dcalc = 1.500g / cm3,测量40777反射(5.594°<26 <56.786 °),3413独特(RINT = 0.1040,RSIGMA = 0.0584),用于所有计算。 最终的RI为0.0771(I> 2CR(I))和WR2为0.2541(所有数据)。

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