Intramolecular Charge Transfer Effects on Flutamide Drug

Spectral characteristics of flutamide drug have been studied in various solvents and β-cyclodextrin (β-CD). The inclusion complex of flutamide with β-CD is analysed by UV-visible, fluorimetry, FT-IR, 1H NMR, SEM, DSC and AM1 methods. In all solvents, flutamide exhibits a dual fluorescence. The longer wavelength emission (A band ∼380 nm) is due to intramolecular charge transfer state (ICT) and the shorter wavelength emission (B band ∼285 nm) originates from a locally excited state. In β-CD, the increase in the fluorescence intensity of ‘A’ band indicates ICT emission enhanced in the β-CD medium. β-CD studies shows isopropyl group is present in the interior part of the β-CD cavity whereas amino and CF₃ groups are present in the outside of the β-CD cavity. A mechanism is proposed to explain the 1:1 inclusion process.     

Emissive Properties and Intramolecular Charge Transfer of Pyrazoloquinoline Derivatives

The fluorescence properties of several pyrazoloquinoline derivatives were performed by stationary as well as by time-resolved spectrosopy. Non-donor-substituted compounds show a high quantum yield; transition dipole moments of absorption and fluorescence as well as experimental and calculated lifetimes are in excellent agreement. The donor-substituted compound DMA-DPPQ exhibits a charge transfer fluorescence in polar solvents. Additionally, dual fluorescence appears in polar protic solvents. The nature of the charge transfer state is discussed with respect to the the TICT model.     

Spectroscopic and Conductive Properties of Some Charge Transfer Complexes of Iodine

Abstract

The interaction of iodine with donor bases such as neutral red (NR) and 1, 10 -phenanthroline (Ph) have been studied spectrophotometrically in C₂H₅OH. The results indicate the formation of 2:3 charge transfer complexes of the type (base)₂3I₂. Mass, Raman and ¹H NMR spectra have been recorded for each complex. I₃ ^? and I₂ species are observed in these complexes. In addition, the d.c. conductivity is measured in the range (300–400) K°. The energy gap of the ionic conduction has been calculated. The conduction process is thought to involve iodide transfer between polyanions.     

碳纳米管-苯胺电荷转移复合物中的胺荧光淬灭效应(英文)

Under refluxing, carbon nanotube (CNT) and aniline (An) can form the charge transfer complex (CTC) of CNT-An.The corresponding fluorescence emission peaks lied at 564nm and 606nm, respectively, with the excitation wavelength of 516nm in the acetone soluti…     

利用拉曼光谱分析冰Ih相的表面薄层的氢键结构

水是生活中一种最基本且最重要的物质,由于它的一些奇特性质和反常物性,得到了广泛的研究,而拉曼光谱是研究水分子结构的一种非常合适的方法,它通过获得分子的振动和转动信息来理解分子结构和分子间的相互作用。在常压下测量了-20～-190 ℃温度范围内冰Ih相的表面薄层的拉曼光谱,实验结果发现随温度降低,冰Ih相的O∶H范德瓦尔斯键向高波数方向移动,而O-H极性共价键向低波数方向移动;且拉曼频移与温度呈线性关系,通过对不同振动模式的斜率进行比较,判断其键长的伸缩变化关系,从而证明了冰Ih相密度随温度的减小而增大,采用氢键理论(结构)给予了解释。同时,发现在-150 ℃时,O-H键反对称伸缩振动模式和O∶H键振动模式的拉曼峰强发生了突变,这表明冰Ih相发生了相变--冰Ⅺ相(冰Ih的质子有序相)。     

基于分子内电荷转移的多枝状荧光探针光学性质与响应机理分析

本文采用含时密度泛函理论研究了用于检测生物硫醇的荧光探针分子的光学性质.通过计算探针分子Mol.1、Mol.2和Mol.3与半胱氨酸和同型半胱氨酸反应前后的单光子吸收和发射性质,研究了碳碳三键和苯环结构对荧光探针性质的影响.随着给电子体三苯胺结构的逐渐完善和碳碳三键的加入,探针分子的振子强度逐渐增大,展现出了更好的荧光探针性质.同时,研究了不同侧枝数目对探针分子性质的影响,结果表明,相较于单枝分子Z1和三枝分子Mol.3,两个侧枝的探针分子Z2振子强度更大,检测效果更佳.增加了碳碳三键和苯环后的单枝新型探针分子Mol.4,相较于具有三枝结构的探针分子Mol.3,具有良好的探针性质,且结构更为简单.     

Charge Exchange Component of n-p Interactions

An extra term of n-p effective interaction containing charge exchange component is proposed and applied to treating odd-mass nuclei with shape coexistence. The energy spectra and some E2 transition branching ratios are calculated for odd-A nuclei ^113~125Sb,^115~127I. With the inclusion of new term, an overall agreement with experiment is much improved.     

约瑟夫森电荷量子比特的耗散特性

从环境的两种不同初态(粒子数态和热平衡态)出发,对电荷量子比特的时间演化进行了深入的研究.结果表明:在温度较高(500 mK)时,如果环境初始处在粒子数态,那么翻转算符的衰减时间会比热库处于热平衡态时更长,并且10＞态的布居数算符的渐近值也更小.在温度极低(50 mK)时,电荷量子比特的动力学特性就与环境的初态无关.     

荷移分光光度法测定甲氧氯普胺

采用分光光度法研究了甲氧氯普胺与茜素红之间的荷移反应。确定了反应条件,建立了一种快速简便测定甲氧氯普胺的荷移分光光度法。实验表明,甲氧氯普胺与茜素红在乙醇—水介质中,室温条件下即可形成稳定的1：2型荷移络合物,该络合物的λmax=528nm,表观摩尔吸光系数为4.66×10^3L·mol^-1·cm^-1。甲氧氯普胺药物质量浓度在10-70mg/L范围内服从比耳定律,相关系数为0.9991。测定结果的相对标准偏差为1.08%（n=6）,回收率为98.2%—101.6%。     

富勒烯C60及其电荷转移配合物的吸光、发光特性研究

对Ｃ６０克量级合成与制备获得成功以来的近七、八年间有关溶液中Ｃ６０及其电荷转移配合物（ＣＴＣ）吸光、发光特性研究做了详尽综述。化学特性的改善展示了Ｃ６０及其ＣＴＣ作为新型材料的潜在应用前景。     

核物质热力学性质的同位旋和动量相关性

利用3个具有不同的同位旋和动量相关性的热力学模型研究了非对称核物质的热力学性质, 它们是重离子碰撞中同位旋弥散数据约束下的、 同位旋和动量相关的MDI模型, 完全动量无关的MID模型, 以及同位旋标量动量相关的extended MDYI(eMDYI)模型。 主要研究了同位旋非对称热核物质的对称能和系统力、 化学不稳定性以及液气相变的温度效应。 MDI模型对称能的温度效应来源于动能和势能两部分贡献, 而MID和eMDYI模型只有势能部分对对称能的温度效应有贡献。 研究结果还表明, 力学不稳定性区域、 化学不稳定性区域和液气共存区都依赖于模型的同位旋和动量相关性, 以及对称能的密度依赖关系。In this article, three models with different isospin and momentum dependence are used to study the thermodynamical properties of asymmetric nuclear matter. They are isospin and momentum dependent MDI interaction constrained by the isospin diffusion data of heavy ion collision, the momentum independent MID interaction and the isoscalar momentum dependent eMDYI interaction. Temperature effects of symmetry energy, mechanical and chemical instability and liquid gas phase transition are analyzed. It is found that for MDI model the temperature effects of the symmetry energy attribute from both the kinetic and potential energy, while only potential part contributes to the decreasing of the symmetry energy for MID and eMDYI models. We also find that the mechanical instability, chemical instability and liquid gas phase transition are all sensitive to the isospin and momentum dependence and the density dependence of the symmetry energy.     

The Raman Spectrum of The 3-Br Pyridine-Bromine Charge Transfer Complex

The formation of a charge transfer complex between pyridine and halogens or mixed halogens^(1,2) brings about perturbations in the infrared spectra of the pyridine molecule and many halogen complexes show two bands in the low frequency range, which can be attributed to the v _X-X and v _N…Y stretching vibrations. ^(3–5). However, by comparison, very little has been reported on the Raman spectra of such complexes. Klaboe⁽⁶⁾ studied the v _Br-Br Raman frequency of some bromine complexes and more recently the Raman spectra of pyridine complexed with Ni (CN)₄ ⁽⁷⁾ and TiCl₄ ⁽⁸⁾ have been reported. In this work, the Raman spectrum of the 3-Br pyridine-bromine charge transfer complex is investigated.     

The Influence of Asymmetric Charge Transfer on IR Spectra of Excited Quadrupole Molecules

Optics and Spectroscopy - The influence of symmetry breaking caused by charge transfer in excited quadrupole molecules of the D-π-A-π-D or A-π-D-π-A type, where A and D are the...     

阿莫西林的荷移光谱测定方法研究

在丙酮介质中阿莫西林与 7,7,8,8-四氰基对二次甲基苯醌 (TCNQ)荷移反应 ,形成 1∶ 1络合物 ,在74 4nm和 84 5 nm处有较强光吸收 ,表观摩尔吸光系数分别为 1.2× 10 4L· mol-1· cm-1和 1.8× 10 4L·mol-1· cm-1,阿莫西林的浓度在 10— 15 0 mg· L-1范围内符合比耳定律。在乙醇介质中 ,阿莫西林与对苯醌 (p- BQ)反应 ,形成 1∶ 1络合物 ,最大吸收波长为 4 80 nm,表观摩尔吸光系数为 1.92× 10 3 L· mol-1·cm-1。阿莫西林的浓度在 2 0— 2 0 0 mg·L-1范围内符合比耳定律。两种方法相对标准偏差分别为 1.2 %和1.5 % (n=8) ,用于测定阿莫西林制剂的含量 ,结果与标准方法一致。     

C60与有机胺电荷转移配合物的吸光特性比较研究

考察了甲苯、ＣＣｌ４和环己烷三种溶剂体系中,Ｃ６０同Ｎ,Ｎ二甲基苯胺（ＤＮＡ）、二乙胺（ＤＥＡ）及三乙胺（ＴＥＡ）电荷转移配合物（ＣＴＣ）的吸光特性。发现不同胺同Ｃ６０作用的程度在不同溶剂介质中均存在如下顺序：环己烷〉ＣＣｌ４〉甲苯。而在同一溶剂介质中,不同胺同Ｃ６０作用的程度各不相同。测定了电转移配合物在不同溶剂介质中的摩尔吸光系数及形成常数,并考察了温度对电荷转移配合物形成常数的影响。     

克拉霉素与醌茜素的荷移反应及其测定

克拉霉素与醌茜素在乙醇 -水介质中发生电荷转移反应 ,形成 1∶ 1的电荷转移络合物。该络合物在5 80 nm处有最大吸收 ,表观摩尔吸光系数为 3.74× 1 0 3 L·mol-1· cm-1 ,稳定常数是 2 .6× 1 0 5。建立了一种快速测定克拉霉素的荷移分光光度法。药物浓度在 0— 1 0 0 mg/ L范围内服从比耳定律。本法测定了克拉霉素制剂中有效成分的含量 ,与文献法结果基本吻合。     

交沙霉素与红紫素的荷移反应及其测定

交沙霉素与红紫素在乙醇-水介质中发生电荷转移反应,荷移络合物在545nm处有最大吸收,表观摩尔吸光系数是4.09×103L·mol-1·cm-1,该络合物的组成是1∶1,稳定常数是3.9×104.药物浓度在0-120mg/L范围内服从比耳定律,建立了一种测定交沙霉素的荷移分光光度法.当交沙霉素浓度为80mg/L时,6次测定结果的相对标准偏差为1.84%.利用本法测定了交沙霉素制剂中有效成分的含量,并与文献法进行比较,二者结果基本吻合,回收率在96%以上.     

色氨酸与2,3-二氯-5,6-二氰-1,4-苯醌荷移反应的研究

用分光光度法研究了色氨酸与2,3-二氯-5,6-二氰-1,4-苯醌(DDBQ)的荷移反应。由实验得知,在硼砂缓冲溶液中,40℃水浴加热30min,两者可生成稳定的1∶2型荷移络合物。此络合物的λmax=341nm,表观摩尔吸光系数ε=1.4×105L·mol-1·cm-1,浓度在2—12μg/mL的范围内符合比耳定律,回收率在98.73%—101.7%之内,相对标准偏差在3.2%以内。     

荷移分光光度法测定罗红霉素

本文研究确定了罗红霉素与甲酚红的荷移反应条件。在乙醇 丙酮介质中 ,罗红霉素与甲酚红在35℃的温度时发生荷移反应 ,产物的最大吸收波长为 456nm ,表观摩尔吸光系数为 1 0 5× 1 0 4L·mol- 1 ·cm- 1 ,罗红霉素的浓度在 0～ 80mg·L- 1 范围内与吸光度呈线性关系 ,相对标准偏差为 0 87% (n=6) ,回收率在 98%以上。测定了荷移络合物的组成比为 1∶1 ,探讨了反应机理 ,其中罗红素作为电子给予体、甲酚红作为电子接受体发生了电荷转移反应。