化合物

By the comparison of electronic spectrum and Z-scan of different substituted MPc and MNc, the peripheral substituted MNc had better nonlinear optical properties. It provided a new method to the improvement of the performance of reverse saturable absorption of the laser protective materials.

对不同金属轴向取代的萘酞菁化合物的电子光谱和Z-扫描进行了横向比较，并对相同取代基、金属轴向取代的酞菁化合物和萘酞菁化合物进行了纵向比较，发现周围取代的金属萘酞菁化合物具有较好的非线性光学性能，为提高材料的反饱和吸收性能提供了一种新的途径。

The facts that type I compounds could easily undergo deamination reaction to form α-methylene cyclopentanone derivatives and they could react with glutathione to form an adduct provided sufficient evidence for the hypothesis that the compounds acted as masked α-methylenecyclopen- tanones and reacted with biologically important sulfhydry-containing enzymes, and thus produced anticancer activity.

Ⅰ类化合物在稀溶液中极易进行去胺基化反应形成α-亚甲基环戊酮类化合物。并且Ⅰ类化合物于稀溶液中易与谷胱苷肽进行结合，这些事实为Ⅰ类化合物作为隐蔽的α-亚甲基环戊酮与酶进行加成，从而导致酶失活而具有抗癌活性的设想提供了证据。

All the compounds are characterized by IR and elemental analysis.we design and prepare a bipyridinium supramolecular compound and six coordination compounds, which are also characterized by IR, elemental analysis and X-ray structure analysis. According to X-ray structure analysis, hydrogen bonds and n-n stocking interactions participate in the architecture of three-dimensional framework [H2L1 (NO3)2 (H2O)2]n; one-dimensional zigzag coordination polymer [Hgl21.5CH3OH]n; binuclear metallamacrocycle (HgI2L2)2 3H2O; helical double-stranded one-dimensional coordination polymer [Co2(L2)2-2CH3OH]n; double-stranded one-dimensional coordination polymer [Co2(L3)2-CH3OH-CH3CN]n; and three-dimensional compound [Cu(C5H4NCOO)2(H2O)2]-H2O with hydrogen bonds, three-dimensional coordination polymer {[Cd(C5H6NCOO)2H2O]-DMF}n, which are indirectly obtained from the precursor ligand L3 through metal ion induced the hydrolysis of diamide and self-assembled with the hydrolyzate.

我们首次合成了一个双吡啶鎓超分子化合物和六个过渡金属配合物，并通过IR谱，元素分析和X-ray晶体衍射分析对它们进行了表征。X-ray晶体结构分析表明：超分子化合物[H_2L1·(NO_3)_2·(H_2O)_2]_n是由多种氢键和芳香环间的π-π堆积作用构建的三维无限结构；[HgI_2(L1)·1.5CH_3OH]_n是一维锯齿状配位聚合物；(HgI_2L2)_2·3H_2O是双核金属大环化合物；[Co_2(L2)_2·2CH_3OH]_n是具有一维双螺旋结构的配位聚合物；[Co_2(L3)_2·CH_3OH·CH_3CN]_n为一维双链结构的配位聚合物；以及由非直线形配体L3在金属离子Cu和Cd的诱导作用下发生水解，并且金属离子与水解产物——异烟酸根离子自组装，形成了三维氢键超分子化合物[Cu(C_5H_4NCOO)_2(H_2O)_2]·H_2O和三维配位聚合物{[Cd(C_5H_6NCOO)_2H_2O]·DMF}_n。

The changes in phase structure and Curie temperature of the Sm2Fe17 compound after nitrogen absorption were studied by using X-ray diffraction, differential thermal/thermo-gravimetric analyzer and magnetic measurement. The results of X-ray diffraction showed that the diffraction peaks of the Sm2Fe17 compound shifted toward lower angle after nitrogen absorption, and the characteristic peaks of α-Fe were observed. This showed that the unit cell of Sm2Fe17 expanded, the compound was decomposed to a certain extent and the characteristic peaks of α-Fe appeared.

通过X-射线衍射、差热－热重联用仪以及磁测量等手段，研究了Sm2Fe17化合物吸氮后的相结构及居里温度的变化行为。X-射线衍射表明，吸氮后Sm2Fe17化合物的衍射峰向小角度方向偏移，并且出现了α-Fe的衍射峰，这说明吸氮后化合物的晶胞有所膨胀，并且化合物有一定的分解，产生了α-Fe。

In our research on study chemical reaction of active methylene compounds and brom-acetophenone. Because of brom-acetophenone is compound that contain carbonyl and halogen ,which will take place electrophilic substitution and nucleophilic addition. When active methylene compounds are ethyl acetoacetate and β-diketone, controlling reaction condition, we have found that mono-substitution's production and di-substitution's. production is isolated; active methylene compounds are acetoacetanilide and acetoacetanilide derivate, pyrrolidin-2-one derivants were obtained by substitution and close-ring reaction .but there is no report about it.

本文是让活泼亚甲基类化合物与溴代苯乙酮发生化学反应，由于溴代苯乙酮是含有羰基的卤代烃结构，它可以发生亲电取代和亲核加成反应，当活泼亚甲基类化合物为乙酰乙酸乙酯和β-二酮时，控制反应条件可以发生单取代和双取代两种产物；当活泼亚甲基类化合物为乙酰乙酰芳胺类化合物来反应时，溴代苯乙酮中的羰基与氨基会发生分子内的关环反应生成吡咯烷-2-酮衍生物，这在以前的研究中是没有发现的。

A new technology, Supercritical Fluid CO_2 Extraction, was also supplied to study the plant. The technological parameter was optimal. Total extract of SFE-CO_2 were 4.86 times of the essential oil extracted by SDE, main active extracted constituents were 1.36% high than SDE. The chemical constituents of SFE-CO_2 were also analyzed by GC-MS. 57 constituents were identified, 29 constituents of them were first discovered. 24 constituents were discovered in two extract. Fingerprint is a good technology to elevate the quality of herb medicine. The main active fraction can be extracted by SDE and SFE, Fingerprint was studied respective, chromatographic parameter was acquired. 22 peaks were assigned common peaks in the spectrum of essential oil, 17 peaks were assigned to common peaks in the spectrum of SFE extract.

采用现代共性关键技术超临界CO_2萃取技术，通过正交试验，优选了超临界CO_2提取牛至挥发油的工艺，并与传统的水蒸气蒸馏法进行了比较研究，结果显示：前者提取有效部位的收率为后者的4.87倍，主要有效成分的转移率是后者的1.36倍；采用GC-MS分析方法和NIST质谱库检索，对SFE和SDE所提化学成分进行比较，SFE分离鉴定了57种化合物，占提取物总含量的86.96％，其中29种化合物为首次从该植物中鉴定；后者分离鉴定了69个化合物，占提取物总量的98.28％，其中27种化合物为首次从该植物中鉴定；两种方法的提取物中共有成分25种，包括主要有效成分麝香草酚、香荆芥酚、对聚伞花素等。

A catalyst composition for the polymerization of propylene comprising one or more Ziegler-Natta procatalyst compositions comprising one or more transition metal compounds and one or more esters of aromatic dicarboxylic acid internal electron donors; one or more aluminum containing cocatalysts; a selectivity control agent comprising at least one silicon containing compound containing at least one C1-10 alkoxy group bonded to a silicon atom, and one or more activity limiting agent compounds comprising one or more aliphatic or cycloaliphatic carboxylic acids; alkyl-, cycloalkyl- or alkyl-ester derivatives thereof; or inertly substituted derivatives of the foregoing.

一种用于丙烯聚合的催化剂组合物，所述催化剂组合物包括：一种或多种齐格勒-纳塔主催化剂组合物，该主催化剂组合物包括一种或多种过渡金属化合物和一种或多种芳族二羧酸酯内部电子给体；一种或多种包含铝的助催化剂；选择性控制剂，该选择性控制剂包括至少一种包含硅的化合物，该化合物包括至少一种与硅原子连接的C 1-10 烷氧基；和一种或多种活性限制剂化合物，该活性限制剂包括一种或多种脂族或脂环族的单或聚羧酸类、其烷基-、环烷基-或烷基-衍生物、或上述惰性取代的衍生物。

The chemical constituents of Huperzia serrata Trev. are mainly flavonoids, triterpenoids and alkaloids. In order to get further comprehension of lycopodium alkaloids, we studied the low-polar section of the alkaloids extraction of Huperzia serrata and 19 alkaloids were isolated by ways of silica gel, RP-18 and Sephadex LH-20 etc. All of their structures, including five new compounds and two known ones that were firstly found from this genus, were elucidated with the help of Mass, IR, NMR spectra and so on. The five new alkaloids (HS-07, HS-08, HS-09, HS-10 and HS-11) are belonged to lycopodine class. The other two ones that were new to this genus (HS-18 and HS-19) are belonged to miscellaneous group.

蛇足石杉的主要化学成分为黄酮，三萜和生物碱，为进一步了解该植物的生物碱成分，我们研究了蛇足石杉氯仿总碱低极性部位的生物碱成分，运用正相硅胶、反相RP-18、凝胶LH-20等方法分得了19个生物碱，并通过质谱、红外、核磁共振等波谱鉴定了它们的结构，其中5个为新化合物，2个为首次从该属植物中分离得到的化合物，所分得的新化合物：HS-07、HS-08、HS-09、HS-10和HS-11均为lycopodine类石松生物碱，首次从该属植物中分得的化合物为miscellaneous类：HS-18和HS-19。

Twenty-four compounds with a new constitute have been isolated and identified from Acropora pulchra collected from the North Sea , Porites Compressa Dana and Laurencia majuscule Lucas collected from Xisha Islands.

本课题对采自中国北海的佳丽鹿角珊瑚和南海西沙群岛的扁缩滨珊瑚、略大凹顶藻的化学成分进行分离，从中分离鉴定了24个化合物，其中一个为新化合物，7个为纯化合物，经GC-MS鉴定了14个化合物。

The most parts of thesis as follows:1. Five symmetrical intra-molecular charge transfer oligomeric phenylene vinylene light emitting materials were designed and synthesized using oligomeric phenylene vinylene as a framework.2. The structures of target molecule were characterized by ~1HNMR,~(13)CNMR, IR, MS and element analysis.3. In order to study the influence of the location and numbers of electron-donor and electron-acceptor on their photoelectric performance by changing length of OPV chain, the UV spectra and fluorescence spectra of target compounds has been compared. We have researched into main factors effecting on material emitting red-shift; organic electroluminescence device was prepared using the compound P4. The capability of eletroluminescence was researched.4. The photoelectric properties of P4 was explained by quantum chemical calculation (the Gaussian 98 quantum chemistry program). It is greatly contributed know the whole process of charge transfer to guide the design of red emitters.

本文研究的内容主要包括以下部分：(1)设计并合成5个对称的以齐聚苯乙烯类为骨架的分子内电荷转移型齐聚苯乙烯类发光材料；(2)通过IR，MS，~1H-NMR，~(13)C-NMR和元素分析对所合成的目标化合物进行表征；(3)通过对目标化合物的紫外光谱和荧光光谱比较分析，研究改变OPV的长度，电子给体和电子受体的位置及数量对其光电性能的影响，探讨材料发射红移的主要因素；选取性能良好的目标化合物P4制备成OELD器件，对其电致发光性能进行研究；(4)运用Gaussian98量子化学程序包，采用量子化学方法对目标化合物P4的光电性能从理论加以解释，进一步认识荷移跃迁的整个过程，为红光材料的设计加以指导。

The split between the two groups can hardly be papered over.

这两个团体间的分歧难以掩饰。

This approach not only encourages a greater number of responses, but minimizes the likelihood of stale groupthink.

这种做法不仅鼓励了更多的反应，而且减少跟风的可能性。