衍生物

Taking double-layer paracyclophane derivatives, platinum acetylide chromophores, porphyrin derivatives, C60, C70 and octupolar molecule as the example, our research results have been reported.

以双层二聚二甲苯邻甲酸衍生物、铂乙炔化物、卟啉衍生物、C60、C70、八极矩分子为例，报道了我们在这方面的研究结果。

By density functional theory B3LYP method with 6-31G basis set, the geometry and electronic structure of the natural inhibitor and derivatives of Adenylosuccinate synthetase were optimized and their thermodynamic stability was also analyzed. The relationship between their electronic structures and bioactivities were discussed based on the Mulliken bond order, atomic net charge distribution and molecular surface electrostatic potential.

利用密度泛函B3LYP方法选择6-31G基组对腺苷酸琥珀酸合成酶天然抑制剂及其衍生物的结构进行优化，并对其稳定性进行了分析，同时采用Mulliken键序、原子电荷分布、表观静电势等对AdSS抑制剂及其衍生物电子结构与其生物活性相关性进行了理论研究。

Nitrogen species in FCC diesel oil include basic species (such as aniline, quinoline, and their derivatives) and nonbasic species (such as indole, carbazole, and their derivatives), and only 0.1% of the nitrogen compounds are quinoline and about 64% of them are carbazole and their derivatives.

氮化物主要为碱性氮化物和非碱性氮化物两大类型，其中碱性氮化物主要是苯胺及其衍生物，喹啉含量很低，约占总氮质量分数的0.1%，非碱性氮化物主要包括吲哚及其衍生物和咔唑及其衍生物，而咔唑类氮化物一般约占总氮质量分数的64%。

The results showed that the LUMO values are -3.19eV for organic oxadiazole,-3.16eV for macromolecular oxadiazole and -3.21eV for Poly(1,3,4-oxadiazole) and their HOMO values are all under -6.0eV, hinting that they show good hole-blocking characteristics.

利用循环伏安法测定了三种不同类型衍生物的带隙和HOMO、LUMO能级，噁二唑类小分子、大分子、聚合物衍生物的LUMO能级分别为-3.19eV、-3.16eV、-3.21eV，有利于电子的注入，三种噁二唑衍生物的HOMO能级都在-6.0eV以下，对空穴也有很好的阻挡作用。

The novel methods for the synthesis of Camptothecin intermediates were described as Friedlandle. Second, we synthsized the key compound—BI, and then made some improvements and innovations of the methods from the reference. The method of using more economically phenylaldehyde derivatives and phenylamine derivatives instead of o-aminobenzaldhyde was worked out.

然后成功合成重要的中间体BI，并且在参考原始文献的基础上作出了改进和创新，使用更便宜的苯甲醛衍生物和苯胺衍生物代替了邻氨基苯甲醛，合成了一系列未关B环的喜树碱中间体衍生物，并获得成功。

The C_(60)-fused tetrahydrofuran derivatives are excellent synthons for further functionalization.While treated with different equiv,of BF_3·OEt_2 at various temperature,several novel functionized fullerene derivatives have been successfully synthesized.2.1,4-Fullerenols C_(60)ArOH were synthesized via the reaction of[60]fullerene with 4-substituted phenylhydrazine hydrochlorides and sodium nitrite under moisture and aerobic conditions.

这种四氢呋喃环合富勒烯衍生物作为一个合成中间体又可发生进一步的衍生化反应，其与不同当量BF_3·OEt_2在不同温度条件下可以得到二氢呋喃环合富勒烯衍生物、三元环合富勒烯衍生物等。2。

Their tribological properties in paraffin and water were investigated with a four-ball test machine, the results shown that the thiadiazole derivatives and the imidazoline borates have better friction reduction and antiwear properties, and the thiadiazole derivatives also have excellent extreme pressure properties in water.

通过在四球摩擦磨损试验机上评价上述两类衍生物分散在液体石腊及水中的抗磨减摩性能，首次发现噻二唑及咪唑啉衍生物在水中也有较好的抗磨减摩性能，且噻二唑衍生物在水中具有良好的极压性能。

The results of calculation will be fundmentally consistent with the experimental values.In addition, we calculated dibenzene chromium and its derivatives, ferroceneand its derivatives. The former had higher symmetry. We studied the substituenteffects by calculating their NMR spectra. The results show that: when we add asubstitute group on one ring of dibenzene chromium, the substitute group will affecttwo benzene rings. The effect is similar to the effect of branched alkanes, namely:the effect on neighbouring groups has transmissibility. Furthermore, the nearer theneighbouring group is, the stronger the effect is. This effect is observed not only onthe substituted ring, but also on the unsubstituted ring.

此外，我们重点计算了二苯铬及其衍生物和二茂铁及其衍生物的核磁共振谱，其中二苯铬及其衍生物选择的是对称性较好的体系，通过计算其核磁共振四川师范大学硕士学位论文谱，探讨其取代基效应，结果表明：在二苯铬的一个环上引入取代基后，取代基对两个苯环的影响，类似于支链院烃引入取代基后的影响：即对邻近基团的影响有传递性，并且对离得近的作用强，对离得远的作用弱，这种作用不仅体现在连有取代基的环上，也体现在没有带取代基的环上。

UV spectra of the n -octanol gels formed by the three gelators indicate that the K bands of benzene rings are red shifted. It reveals that the π-π stack is one of the driving forces for the self-assembly of the gelators. The extent of red shifts of K bands depends on the amount of methyl groups in benzene rings which is in accord with the stabilities of the gels formed by such three gelators.

紫外吸收光谱表明，对比其溶液态，三种衍生物聚集体苯环的K带发生红移，表明π-π堆积作用是亚苄基山梨醇衍生物凝胶剂自组装的驱动力之一；红移的幅度随苯环上甲基数量的增加而增加，这与三种衍生物形成的分子凝胶的热稳定性相吻合。

X 6.36(3)? is formed.Liquid-liquid extraction experiments, between twelve heterocyclic thioalkoxycalix[4]arene on the lower rim, fifteen heterocyclic thioacetamidecalix[4]arene on the upper rim and Na~+、K~+、Cs~+、Mg~(2+)、Cu~(2+)、Co~(2+)、Cd~(2+)、Ni~(2+)、Pb~(2+)、Hg~(2+) and Ag~+ picrates, have been carried out and their results are compared.

分别将十二个下沿含有杂环硫烷氧基杯芳烃衍生物和十五个上沿含有杂环硫乙酰胺基的杯芳烃衍生物与Na~+、K~+、Cs~+、Mg~(2+)、Cu~(2+)、Co~(2+)、Cd~(2+)、Ni~(2+)、Pb~(2+)、Hg~(2+)和Ag~+的十一种苦味酸盐进行了离子萃取实验，并对两类衍生物与不用金属离子的萃取能力进行了分析和比较。

On the other hand, the more important thing is because the urban housing is a kind of heterogeneity products.

另一方面，更重要的是由于城市住房是一种异质性产品。

Climate histogram is the fall that collects place measure calm value, cent serves as cross axle for a few equal interval, the area that the frequency that the value appears according to place is accumulated and becomes will be determined inside each interval, discharge the graph that rise with post, also be called histogram.

气候直方图是将所收集的降水量测定值，分为几个相等的区间作为横轴，并将各区间内所测定值依所出现的次数累积而成的面积，用柱子排起来的图形，也叫做柱状图。