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<正> The title com pound (HHOMP) has been synthesized with the pho-toinduced condensation of acetone and pyrrole in the presence of iodoaromatic hydrocarbons, and its molecular and crystal structures have been determined by X-ray analysis. C28H36N4, Mr = 428. 63, triclinic; space group P1; a =10. 165(3), b = 10. 185(2), c=13. 012(3)(?); α=85. 41(2), β=67. 84(2), γ= 89. 75(2)°; V = 1243 (?)3; Z = 2; D = 1. 145g. cm-3; μ= 0. 635cm-1; F (000) = 464. Although the HHOMP molecule twists, it is found that the four nitrogen atoms are still in a plane.  相似文献   

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用从头算方法,在HF/STO-3G、HF/3-21G和HF/6-31G水平上研究了小硅化物SiX^m4的成键倾向性。计算结果表明,所研究的分子势能曲线均有稳定的极小值(SiLi4除外)。与已知的稳定分子SiH1、SiF4和SiCl4比较,含惰性元素的未知分子SiHe^4+4、SiNe^4+4和SiAr^4+4比含碱金属和碱土金属的未知分子SiLI4、SiNa4、SiBe^4+4和SiMg^4+4有  相似文献   

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张宏  孙仁安  李纳  阎杰 《结构化学》2006,25(3):279-284
1 INTRODUCTION In the later 60s of last century, silicon substituted for germanium to present as mainstream in semicon- ductor. The semi-conductive devices made by silicon have many advantages, for example, refractory pro- perty, high radioresistance, simple and stable process- ing technic, high machinability and low cost. So it was widely used to manufacture large power appara- tuses, for instance, digit and linear integrated circuit, large scale integrated circuit (LSI), etc. Thus, th…  相似文献   

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