N-(2-氟苯甲酰基)-N''''4-甲基苯基硫脲的结构和构型研究

合成了未见报道的N-(2-氟苯甲酰基)-N′-4-甲基苯基硫脲(FBTT),并测定了其晶体结构.晶体属三斜晶系,空间群P1,a=0.8413(5)nm,b=0.9532(5)nm,c=0.9927(6)nm,α=66.24(2)°,β=85.40(2)°,γ=72.27(2)°,V=0.693.2(7)nm3,Z=2.利用量子化学密度泛函理论,以步长为30°旋转扭角θ[N(2)-C(14)-N(1)-H(12)]得势能曲线.优化的最稳定的构型与得到的晶体结构一致.讨论了分子的构型,估算了氢键的键能.     

锡(Ⅳ)-偶氮邻苯二酚苯基荧光酮-吐温-80体系分光光度法测定岩石中微量锡

pH值在7.0-8.5的范围内，锡与偶氮邻苯二酚苯基荧光酮、吐温－80形成络合物，其最大吸收峰556nm，摩尔吸光系数2.9×10^5L·mol^-1·cm^-1，锡的含量在0－6μg/25mL范围内遵守比耳定律，本方法对干扰离子的影响和消除进行了研究，本方法已被用于岩石样中锡的测定，结果满意。     

High—Efficiency Organic Double—Quantum—Well Light—Emitting Devices Using 5,6,11,12—Tetraphenylnaphthacene Sub—monolayer as Potential Well

The double-quantum-well organic light-emitting devices of indium-tin-oxide (ITO)/NPB (50nm)/rubrene (0.05nm)/NPB (4nm)/rubrene (0.05nm)/Alq3 (50nm)/LiF (0.5nm)/Al were fabricated, in which N,N-bis-(1-naphthyl)-N,N‘-diphenyl-1,1‘-biphenyl-4,4‘‘‘‘‘‘‘‘-diamine (NPB) is used as a barrier potential or hole transport layer, tris (8-hydroxyquinoline) aluminium (Alq3) used as electron transport layer, and 5,6,11,12-tetraphenylnaphthacene (rubrene) as a potential well and emitter. The brightness can reach 18610cd/m^2 at 13V. The maximum electroluminescent efficiency of the device was 6.61cd/A at 7V, which was higher than that of common dope-type devices. In addition, the electroluminescence efficiency is relatively independent of the drive voltage in the range from 5 to 13V.     

First Total Synthesis of 12-Hydroxy-13-methylpodocarpa-9, 11, 13-trien-3-one

12-Hydroxy-13-methylpodocarpa-9, 11, 13-trien-3-one 9 was isolated from the twigs ofCroton salutaris1. Many diterpenes exhibit significant bioactivities, such as antibac-terial and antitumour and 9 has a rare structure. In order to study the relationshipb…     

激发态分子内质子转移分子2－（2′－羟基苯基）间氮杂氧茚“染料”激光特性的实验和理论研究

报道了以Ｎ２激光为泵浦光源，获得激发态分子内质子转移（ＥＳＩＰＴ）分子ＨＢＯ的激光输出现象。其激光转换效率约为１７％，调谐范围为４９５～５４０ｎｍ，最强的输出波长在５１０ｎｍ。以ＨＢＯ的激发态分子内质子转移的光物理和光化学过程为基础，建立了ＨＢＯ产生激光的动态模型，数值模拟了在宽带和窄带情况下激光输出的光谱特性和时间特性，理论计算值与实验观测值很好相符，同时证实了激发态分子内质子转移分子的激光脉冲宽度依赖于激发态分子内质子转移分子的酮式异构体的基态Ｓ′０的寿命     

聚合手性Salen-V（V）配合物催化醛的不对称三甲基硅氰化反应

以聚合手性salen-V(V)为催化剂，对醛的三甲基硅氰化反应进行了研究，在-20℃和1．2％催化剂量下，以苯甲醛为底物获得了91％的ee值和98％的转化率，对其它几种芳香醛和脂肪醛也取得较好的反应结果．催化剂可以方便地回收，重复使用8次仍然保持很好的反应活性和对映体选择性．     

配合物的生成热和配体的质子化热之间的直线焓关系——Ⅶ.Ni(Ⅱ)-2,2′-联吡啶-N-(间位取代苯基)氨基乙酸三元体系

有关Ni(Ⅱ)-N-(间位取代苯基)氨基乙酸二元体系的直线焓和直线熵关系,前文已有报道,本文报告Ni(Ⅱ)-2,2′-联吡啶-N-(间位取代苯基)氨基乙酸(Ni(Ⅱ)-biPy-m-RPhG:R=CH_3,H,CH_3O,Cl)三元体系的生成热研究,发现在此三元体系中亦存在良好的直线焓和直线熵关系。