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Synthesis, Morphology and Concentration-Dependent Photoluminescence of Thermally Stable Dy3+ Activated Phosphor for White LED Applications. 用于白光LED的热稳定Dy3+激活荧光粉的合成、形态和浓度依赖性光致发光。
IF 3.1 4区 化学 Q2 BIOCHEMICAL RESEARCH METHODS Pub Date : 2025-11-12 DOI: 10.1007/s10895-025-04626-y
Bhawna, Ankita Khan, Bhabana Das, Aarti, Shailesh Narain Sharma, A S Rao

Dysprosium ion-doped Calcium Yttrium Tungstate (Ca3Y2WO9) (CaYW) phosphors were synthesised via the solid-state reaction method. The undoped and doped phosphor samples were characterised by the x-ray diffraction (XRD) method. The diffraction peaks of the samples, sintered at 1100 °C, matched well with reported Ca3R2WO9-type patterns [1, 2], confirming the tetragonal crystal system. Scanning electron microscopy (SEM) was utilised to study the surface morphology of the samples. Diffuse reflectance spectroscopy (DRS) measured the optical band gap values. CaYW: xDy phosphors, with different doping concentrations of Dy3+ (x = 1.0, 3.0, 5.0, 7.0, 9.0, and 11.0 mol%), were synthesised, and their photoluminescence (PL) spectra were studied. No noticeable peak shifting with Dy3+ incorporation was observed, indicating retention of the host lattice structure. The emission spectra revealed that the phosphors, when excited at 352 nm, showed intense emission at 575 nm (yellow light), corresponding to the transition 4F9/26H13/2. Concentration quenching occurred after 9.0 mol% of Dy3+ ions, and thus, the optimum phosphor sample is CaYW:9.0Dy3+. For the prepared phosphor, the Commission Internationale de l'éclairage (CIE) coordinates were evaluated and were found in the yellowish-white region with the coordinates of the optimum sample equals to 0.3654, 0.3972. Fourier transform-infrared (FT-IR) spectra were analysed to identify the functional groups present in the samples. Thermogravimetric analysis (TGA) and temperature dependent-photoluminescence (TD-PL) analysis were also done to study the samples in a thermal context. In conclusion, the results of the current study demonstrate that the Dy3+ ions-doped CaYW phosphors may have the potential to be utilised in white light-emitting diodes (w-LEDs).

采用固相反应法制备了掺镝离子的钨酸钙钇(Ca3Y2WO9) (CaYW)荧光粉。用x射线衍射(XRD)方法对未掺杂和掺杂的荧光粉样品进行了表征。在1100℃下烧结的样品的衍射峰与报道的ca3r2wo9型模式匹配良好[1,2],证实了四方晶系。利用扫描电子显微镜(SEM)研究了样品的表面形貌。漫反射光谱(DRS)测量了光学带隙值。合成了不同Dy3+掺杂浓度(x = 1.0、3.0、5.0、7.0、9.0和11.0 mol%)的CaYW: xDy荧光粉,并研究了它们的光致发光(PL)光谱。未观察到Dy3+掺入后的明显峰移,表明主晶格结构保留。发射光谱显示,在352 nm激发下,荧光粉在575 nm处发出强烈的黄光,对应于4F9/2→6H13/2跃迁。当Dy3+离子浓度为9.0 mol%时发生浓度猝灭,因此,最佳的荧光粉样品为CaYW:9.0Dy3+。对所制备的荧光粉进行了国际委员会(CIE)坐标评价,发现在黄白色区域,最佳样品坐标为0.3654,0.3972。傅里叶变换红外(FT-IR)光谱分析,以确定存在于样品中的官能团。热重分析(TGA)和温度依赖光致发光(TD-PL)分析也被用来研究样品在热环境下。总之,本研究的结果表明,Dy3+离子掺杂的CaYW荧光粉可能具有用于白光发光二极管(w- led)的潜力。
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引用次数: 0
Spectroscopic Studies of the Interaction of some Monomer and Homodimer Styrylcyanine Dyes with DNA. 一些单体和同二聚苯乙烯菁染料与DNA相互作用的光谱研究。
IF 3.1 4区 化学 Q2 BIOCHEMICAL RESEARCH METHODS Pub Date : 2025-11-12 DOI: 10.1007/s10895-025-04634-y
Akmal Sh Yarmukhamedov, Eldar N Kurtaliev, Ilzar Khairov, Negmat Nizomov

The interaction of the monomer dyes Sbt ((E)-2-(4-(dimethylamino)styryl)-3-methylbenzo[d]thiazol-3-ium iodide), Sbo((E)-2-(4-(dimethylamino)styryl)-3-methylbenzo[d]oxazol-3-ium iodide), Sil((E)-2-(4-(dimethylamino)styryl)-1,3,3-trimethyl-3 H-indolium perchlorate) and their homodimers Dbt-10, Dbo-10, Dil-10 with salmon DNA were studied using steady-state and time-resolved fluorescence spectroscopic methods. A significant increase in the quantum yield was observed for homodimer dyes upon binding to DNA. Quantum chemical calculations show the formation of the non-emissive TICT state in these dyes. The increase in fluorescence quantum yield upon dye binding to DNA is associated with the restriction of the dye fragments rotations relative to one another in the excited state. For these dyes, the binding constant (Kb) to DNA were determined. Binding affinity depends on molecular structure of studied dyes. It was found that the addition of NaCl to a DNA solution leads to the formation of H-aggregates on the nucleic acid surface. Theoretical modeling shows that monomer and homodimer dyes bind to DNA in the minor groove via hydrogen bonds, Van der Waals and hydrophobic forces, that are main factor in the interaction of probe molecules with nucleic acid.

采用稳态和时间分辨荧光光谱法研究了单体染料Sbt ((E)-2-(4-(二甲氨基)苯基)-3-甲基苯并[d]噻唑-3-碘化ium)、Sbo((E)-2-(4-(二甲氨基)苯基)-3-甲基苯并[d]恶唑-3-碘化ium)、Sil((E)-2-(4-(二甲氨基)苯基)-1,3,3-三甲基-3 h -吲哚高氯酸盐)及其同二聚体Dbt-10、Dbo-10、Dil-10与鲑鱼DNA的相互作用。同型二聚体染料与DNA结合后,量子产率显著增加。量子化学计算表明在这些染料中形成了非发射的TICT态。染料与DNA结合时荧光量子产率的增加与激发态中染料片段相对旋转的限制有关。测定了染料与DNA的结合常数(Kb)。结合亲和力取决于所研究染料的分子结构。研究发现,在DNA溶液中加入NaCl会导致在核酸表面形成h聚集体。理论模型表明,探针分子与核酸相互作用的主要因素是单体和同二聚体染料通过氢键、范德华力和疏水力与DNA在小凹槽中结合。
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引用次数: 0
Unveiling Moisture Detection, Selective Sensing of Zn2+ ion, Antibacterial Analysis of 2-Amino Thiazole-Based Schiff Base: Experimental to Theoretically Approach. 揭示水分检测,Zn2+离子的选择性传感,2-氨基噻唑基希夫碱的抗菌分析:从实验到理论的探讨。
IF 3.1 4区 化学 Q2 BIOCHEMICAL RESEARCH METHODS Pub Date : 2025-11-12 DOI: 10.1007/s10895-025-04632-0
Pragyan P Dash, S Puri, S Saipraba, S Mishra, R Das, R Bhaskaran, A K Barick, S Murugesan, P Mohapatra, Suban K Sahoo, Bigyan R Jali

Development fluorescence chemosensor for selectively detection of a particular analyte intriguing tuning environmental, biological and pharmaceutical applications. In this regard, a simple and cost-effective Schiff base molecular probe, namely, (E)-3-((thiazol-2-ylimino)methyl)-4 H-chromen-4-one (L) was designed. The molecular probe (L) was used to detect trace amounts of water in DMSO. Upon addition of water, to the DMSO solution of L, the fluorescence emission band decreased significantly, this phenomenon suggests that the quenching in fluorescence emission was attributed to the formation of aggregates, indicating characteristics of aggregation-caused quenching-emission (ACQE). On the other hand, the probe (L) was selectively sensing Zn2+ ions over other metal ions. The change in emission band (blue shifted ~ 68 nm) is due to supersession of photo-induced electron transfer (PET) and inhibition of -C = N isomerisation. Using the Benesi-Hilderbrand plot, the binding stoichiometry is found to be 1:1. Theoretical calculations (DFT and TDDFT) have been explored to find the binding mechanism of the formation of the complex. Using four clinical drug-resistant microorganisms, the disc diffusion technique was used to perform the antibacterial test of L and L-Zn2+. The highest ZOI of these is seen in B. subtilis and S. aureus, which had diameters of 13 mm and 15 mm in L-Zn2+ and 10 mm and 12 mm in L and lowest ZOI was found in E. coli and K. pneumoniae with 12 mm and 11 mm in L-Zn2+ and 8 mm and 6 mm in L. Even at the lowest dose in both samples, the MIC and MBC analyses verify that there is around 99.9% inhibition.

开发荧光化学传感器,用于选择性检测特定分析物,有趣的调谐环境,生物和制药应用。为此,设计了一种简单、经济的希夫碱分子探针(E)-3-((噻唑-2-ylimino)甲基)-4 H-chromen-4-one (L)。分子探针(L)用于检测DMSO中微量的水。在L的DMSO溶液中加水后,荧光发射带明显减小,这一现象表明荧光发射的猝灭是由于聚集形成的,具有聚集引起的猝灭(ACQE)特征。另一方面,探针(L)选择性地检测Zn2+离子而不是其他金属离子。发射带的变化(蓝移~ 68 nm)是由于光诱导电子转移(PET)的消除和c = N异构化的抑制。使用Benesi-Hilderbrand图,发现结合化学计量比为1:1。通过理论计算(DFT和TDDFT)探索了络合物形成的结合机理。采用圆盘扩散法对4种临床耐药微生物进行L和L- zn2 +的抑菌试验。其中,枯草芽孢杆菌和金黄色葡萄球菌的ZOI最高,在L- zn2 +中分别为13 mm和15 mm,在L中分别为10 mm和12 mm;大肠杆菌和肺炎杆菌的ZOI最低,在L- zn2 +中分别为12 mm和11 mm,在L中分别为8 mm和6 mm。即使在两种样品的最低剂量下,MIC和MBC分析也证实了约有99.9%的抑制作用。
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引用次数: 0
Preparation of Nitrogen-Doped Fluorescent Carbon Quantum Dots and Detection Study of Tetracycline. 氮掺杂荧光碳量子点的制备及四环素检测研究。
IF 3.1 4区 化学 Q2 BIOCHEMICAL RESEARCH METHODS Pub Date : 2025-11-11 DOI: 10.1007/s10895-025-04636-w
Li Han, Hui Wang, Jiajia Ye, Fengcui Shi, Wen He, Xing Gao, Yan Gao, Chaoyue Shan, Haidi Cheng

Tetracycline (TC) is a broad-spectrum antibiotic primarily used for the prevention and treatment of bacterial infections in humans and animals. However, excessive use of tetracycline can lead to accumulation in the body, posing risks to human health. In this study, nitrogen-doped fluorescent carbon quantum dots (N-CQDs) were synthesized using sucrose as the carbon source and ethylenediamine as the nitrogen source via a microwave method. N-CQDs were characterized using transmission electron microscopy (TEM), Fourier transform infrared spectroscopy (FT-IR), and ultraviolet-visible spectroscopy (UV-vis). The preparation conditions for N-CQDs were optimized, and the results showed that when glycerol was used as the solvent, the mass ratio of sucrose to ethylenediamine was 1:4, and the microwave power was 800 W, the fluorescence quantum yield of the synthesized N-CQDs reached 43.78%. Optimisation of the TC detection process indicated that at a reaction temperature of 50 °C, a reaction time of 20 min, and a buffer solution pH of 7, within a concentration range of 1.6 to 45 µmol/L, the linear regression equation for TC concentration versus N-CQDs fluorescence quenching degree is (F0-F)/F0 = 0.01042 c + 0.42759, with an R² value of 0.99344 and a detection limit of 45 nmol/L. Experiments were conducted to determine the recovery rate and precision of TC in milk samples. The results showed that the recovery rates ranged from 94% to 107%, while the precision (RSD) was within the range of 1% to 4%, indicating that the synthesized N-CQDs can sensitively and efficiently detect TC. In this study, nitrogen-doped fluorescent carbon quantum dots (N-CQDs) were synthesized using sucrose as the carbon source and ethylenediamine as the nitrogen source via a microwave method.

四环素是一种广谱抗生素,主要用于预防和治疗人类和动物的细菌感染。然而,过量使用四环素会导致四环素在体内积聚,对人体健康构成威胁。本研究以蔗糖为碳源,乙二胺为氮源,采用微波法制备了氮掺杂荧光碳量子点(N-CQDs)。利用透射电子显微镜(TEM)、傅里叶变换红外光谱(FT-IR)和紫外可见光谱(UV-vis)对N-CQDs进行了表征。优化了N-CQDs的制备条件,结果表明:以甘油为溶剂,蔗糖与乙二胺的质量比为1:4,微波功率为800 W时,合成的N-CQDs的荧光量子产率可达43.78%。对TC检测工艺进行优化,在反应温度为50℃,反应时间为20 min,缓冲液pH为7,浓度范围为1.6 ~ 45µmol/L时,TC浓度与N-CQDs荧光猝灭度的线性回归方程为(F0- f)/F0 = 0.01042 C + 0.42759, R²值为0.99344,检出限为45 nmol/L。通过实验确定了牛奶样品中TC的回收率和精密度。结果表明,N-CQDs的回收率为94% ~ 107%,精密度(RSD)为1% ~ 4%,表明所合成的N-CQDs能够灵敏、高效地检测TC。本研究以蔗糖为碳源,乙二胺为氮源,采用微波法制备了氮掺杂荧光碳量子点(N-CQDs)。
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引用次数: 0
Alkyl Chain-Engineered Cyanostilbenes: Integrated Optical, Mechanical, and Mesomorphic Responses from Rigid Cores To Tunable Assemblies. 烷基链工程氰基苯乙烯:从刚性核心到可调组件的集成光学,机械和亚形态响应。
IF 3.1 4区 化学 Q2 BIOCHEMICAL RESEARCH METHODS Pub Date : 2025-11-11 DOI: 10.1007/s10895-025-04635-x
Lange Liu, Jiayi Yu, Xinyi Shu, Jingwei Sun

A series of dicyanodistyrylbenzene derivatives Dn with different length of alkyl chains (C4 ~ 16) were synthesized to systematically study the effects of alkyl chains on the solid state optical properties, mechanofluorochromic (MFC) and liquid crystal (LC) behaviors. The photophysical properties, time resolved photoluminescence (TRPL), fourier transform infrared spectrometer (FTIR) and X-ray diffraction (XRD) were conducted to explore their MFC response. MFC was fundamentally governed by the switch of excited-state species instead of just XRD or fluorescent lifetime changes. Dn with intermediate alkyl lengths (C8, C12) show the most contrastive MFC properties. Meanwhile shorter alkyl chains (C4, C8) promote the reversibility. However, excessive length (C12, C16) diminishes this effect. The mesomorphic properties were studied by combining differential scanning calorimetry (DSC), cross-polarized optical microscopy (POM) and small-angle X-ray diffraction (SAXD) measurements. Alkyl chains mediate a crystal-to-mesophase transition. Shorter chains (C4) favor crystalline rigidity, and LC properties were observed in homologs with longer alkyl chains (C8 - 16). Four phase transitions of melting, SE to SC, SC to SA phase, and finally clearing were displayed in sequence during heating process. Lamellar structures were adopted with alkyl length correlating to interlayer distance and affecting structure stability. Among them, D8 exhibited the widest mesophase range. These findings establish alkyl chains as multifunctional spacers that comprehensively control optical, mechanical and thermal responses via competing π-π and aliphatic interactions.

合成了一系列具有不同长度烷基链(C4 ~ 16)的二氰二苯基苯衍生物Dn,系统地研究了烷基链对固体光学性质、机械荧光(MFC)和液晶(LC)行为的影响。通过光物理性质、时间分辨光致发光(TRPL)、傅里叶变换红外光谱仪(FTIR)和x射线衍射(XRD)研究了它们的MFC响应。MFC基本上是由激发态物质的转换而不是仅仅由XRD或荧光寿命的变化决定的。具有中间烷基长度的Dn (C8, C12)表现出最鲜明的MFC性质。同时,较短的烷基链(C4、C8)促进了反应的可逆性。然而,过大的长度(C12, C16)会减弱这种效果。采用差示扫描量热法(DSC)、交叉偏光显微镜(POM)和小角x射线衍射(SAXD)测量相结合的方法研究了其亚晶性质。烷基链介导晶体到中间相的转变。较短的链(C4)有利于晶体刚性,而在具有较长烷基链(C8 - 16)的同源物中观察到LC性质。在加热过程中依次出现熔融、SE相到SC相、SC相到SA相、最后清除的4个相变。采用层状结构,烷基长度与层间距离相关,影响结构稳定性。其中D8中间相范围最宽。这些发现建立了烷基链作为多功能间隔物,通过相互竞争的π-π和脂肪族相互作用全面控制光学、机械和热响应。
{"title":"Alkyl Chain-Engineered Cyanostilbenes: Integrated Optical, Mechanical, and Mesomorphic Responses from Rigid Cores To Tunable Assemblies.","authors":"Lange Liu, Jiayi Yu, Xinyi Shu, Jingwei Sun","doi":"10.1007/s10895-025-04635-x","DOIUrl":"https://doi.org/10.1007/s10895-025-04635-x","url":null,"abstract":"<p><p>A series of dicyanodistyrylbenzene derivatives Dn with different length of alkyl chains (C<sub>4 ~ 16</sub>) were synthesized to systematically study the effects of alkyl chains on the solid state optical properties, mechanofluorochromic (MFC) and liquid crystal (LC) behaviors. The photophysical properties, time resolved photoluminescence (TRPL), fourier transform infrared spectrometer (FTIR) and X-ray diffraction (XRD) were conducted to explore their MFC response. MFC was fundamentally governed by the switch of excited-state species instead of just XRD or fluorescent lifetime changes. Dn with intermediate alkyl lengths (C<sub>8</sub>, C<sub>12</sub>) show the most contrastive MFC properties. Meanwhile shorter alkyl chains (C<sub>4</sub>, C<sub>8</sub>) promote the reversibility. However, excessive length (C<sub>12</sub>, C<sub>16</sub>) diminishes this effect. The mesomorphic properties were studied by combining differential scanning calorimetry (DSC), cross-polarized optical microscopy (POM) and small-angle X-ray diffraction (SAXD) measurements. Alkyl chains mediate a crystal-to-mesophase transition. Shorter chains (C<sub>4</sub>) favor crystalline rigidity, and LC properties were observed in homologs with longer alkyl chains (C<sub>8 - 16</sub>). Four phase transitions of melting, S<sub>E</sub> to S<sub>C</sub>, S<sub>C</sub> to S<sub>A</sub> phase, and finally clearing were displayed in sequence during heating process. Lamellar structures were adopted with alkyl length correlating to interlayer distance and affecting structure stability. Among them, D8 exhibited the widest mesophase range. These findings establish alkyl chains as multifunctional spacers that comprehensively control optical, mechanical and thermal responses via competing π-π and aliphatic interactions.</p>","PeriodicalId":15800,"journal":{"name":"Journal of Fluorescence","volume":" ","pages":""},"PeriodicalIF":3.1,"publicationDate":"2025-11-11","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145488880","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Bright Photoluminescent Gd-MXene Quantum Dots for Cell Imaging with Synergistic MRI/CT Capability. 具有协同MRI/CT能力的明亮光致发光Gd-MXene量子点细胞成像。
IF 3.1 4区 化学 Q2 BIOCHEMICAL RESEARCH METHODS Pub Date : 2025-11-11 DOI: 10.1007/s10895-025-04621-3
Ayesha Noor, Syed Mujtaba Ul Hassan, Faisal Shahzad, Xubin Zhang, Ahmat Khurshid, Zafar Iqbal, M Tariq Siddique, Noreen Marwat

Theranostic agents, which integrate diagnostic and therapeutic capabilities into a single nanoscale architecture, offer substantial advantages over conventional approaches. In this study, the potential of functionalized two-dimensional Titanium Carbide (Ti₃C₂) MXene Quantum Dots (MQDs) was explored as multifunctional agents capable of Magnetic Resonance Imaging (MRI), Computed Tomography (CT), and Photothermal Therapy (PTT). MQDs inherently possess efficient photothermal properties, making them suitable for therapeutic applications. To enhance diagnostic performance, MQDs were functionalized with Gadolinium (Gd) using two different methods, imparting magnetic properties and a high effective atomic number (Z-number), which significantly improved MRI and CT contrast capabilities. The MQDs, synthesized via a facile one-step hydrothermal method, exhibited an average size of 3.4 ± 1 nm and demonstrated intrinsic photoluminescent properties, enabling an additional Photoluminescence Imaging (PLI) modality. Surface modification with Polyethylene Glycol (PEG) was employed to effectively mitigate Gd-associated cytotoxicity while concurrently enhancing cellular internalization of the MQDs confirmed with RD cell line. Subsequent red (630 nm) laser irradiation studies were done at max power of 550mW for 10 min maximum, results of which confirmed that Gd-functionalization did not compromised the intrinsic photothermal efficiency of MQDs; remarkably, it enhanced the photoluminescence emission intensity by approximately 85% compared to the unmodified MQDs. Finally, this study successfully demonstrates the feasibility and possibility of Gd-functionalized MQDs as robust single-component multimodal theranostic agents capable of simultaneous MRI, CT, and photoluminescent imaging, along with potent photothermal therapeutic efficacy.

治疗剂将诊断和治疗能力整合到一个纳米级结构中,与传统方法相比具有实质性的优势。在这项研究中,探索了功能化的二维碳化钛(Ti₃C₂)MXene量子点(MQDs)作为多功能剂的潜力,能够用于磁共振成像(MRI)、计算机断层扫描(CT)和光热治疗(PTT)。mqd本身具有高效的光热特性,使其适合于治疗应用。为了提高诊断性能,使用两种不同的方法将mqd与钆(Gd)功能化,赋予磁性和高有效原子序数(z数),从而显着提高MRI和CT对比能力。通过简单的一步水热法合成的mqd平均尺寸为3.4±1 nm,具有固有的光致发光特性,实现了额外的光致发光成像(PLI)模式。采用聚乙二醇(PEG)表面修饰可以有效减轻gd相关的细胞毒性,同时增强经RD细胞系证实的mqd的细胞内化。随后的红色(630 nm)激光照射研究以最大功率550mW进行,最长10分钟,结果证实了gd功能化不会影响mqd的固有光热效率;值得注意的是,与未修饰的mqd相比,它的光致发光强度提高了约85%。最后,本研究成功证明了gd功能化mqd作为强大的单组分多模式治疗剂的可行性和可能性,能够同时进行MRI, CT和光致发光成像,并具有强大的光热治疗效果。
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引用次数: 0
Rational Green Synthesis of Eu MOF for Ratiometric Fluorescence Sensing Cu2. 比值荧光感应Cu2的Eu MOF的合理绿色合成。
IF 3.1 4区 化学 Q2 BIOCHEMICAL RESEARCH METHODS Pub Date : 2025-11-10 DOI: 10.1007/s10895-025-04638-8
Yimeng Jia, Mengjiao Nie, Qianzhuo Lei, Ying Zou, Yuxin Yang, Jia He, Shuo Liu

A green-synthesized europium-based metal-organic framework (Eu-ATPA@3RhB) was developed for ratiometric fluorescence sensing of Cu²⁺. Under 245 nm excitation, Eu-ATPA@3RhB exhibits dual emission peaks at 435 nm and 588 nm. When Cu²⁺ is added, the fluorescence at 435 nm is quenched while that at 588 nm remains constant, enabling ratiometric detection based on the I435/I588 ratio. The method shows a linear range of 1-25 µM (R²=0.99) with a detection limit of 0.25 µM, outperforming drinking water standards. Density functional theory (DFT) calculations elucidate the interaction mechanism between Cu²⁺ and Eu-ATPA@3RhB. The Eu-ATPA@3RhB developed in this study showcases the advantages of green synthesis, simplicity, and swiftness, affirming its potential for Cu2+ detection in diverse environmental water samples.

开发了一种绿色合成的铕基金属有机骨架(Eu-ATPA@3RhB),用于Cu 2 +的比例荧光传感。在245 nm激发下,Eu-ATPA@3RhB在435 nm和588 nm处呈现双发射峰。当添加Cu²⁺时,435 nm处的荧光被猝灭,而588 nm处的荧光保持不变,从而实现了基于I435/I588比的比例检测。该方法线性范围为1 ~ 25µM (R²=0.99),检出限为0.25µM,优于饮用水标准。密度泛函理论(DFT)计算阐明了Cu 2 +与Eu-ATPA@3RhB之间的相互作用机制。本研究开发的Eu-ATPA@3RhB展示了绿色合成、简单和快速的优势,肯定了其在不同环境水样中检测Cu2+的潜力。
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引用次数: 0
Triphenylamine-Thiophene Donor-π-Acceptor Chromophores: Synthesis, Photophysical Properties, TD-DFT Analysis, and Anticancer Potential. 三苯胺-噻吩供体-π-受体发色团:合成、光物理性质、TD-DFT分析和抗癌潜力。
IF 3.1 4区 化学 Q2 BIOCHEMICAL RESEARCH METHODS Pub Date : 2025-11-10 DOI: 10.1007/s10895-025-04602-6
Khadra B Alomari, Abrar Bayazeed, Fatimah Alhawiti, Nadiyah M Alshammari, Asmaa L Alanzy, Jihan Qurban, Arwa Alharbi, Nashwa M El-Metwaly

The present work reports the synthesis of novel D-π-A chromophores based on the molecular architecture of triphenylamine (donor group), thiophene (conjugated bridge) and aryl-methanimine (acceptor group). The synthetic route for the target chromophores involved the condensation of 2-formyl-5-(4-(diphenylamino)styryl)thiophene (5) with the appropriate acceptor, either 4-cyanoaniline or 4-nitroaniline (TPAT-CN and TPAT-NO2), respectively. The newly synthesized chromophores were characterized by absorption and fluorescence spectroscopy, as well as other spectral data. The absorption and emission spectra of the chromophores were recorded in DMSO and presented a good Stokes' shift ([Formula: see text] = 5505-5593 cm-1). The FMOs patterns and energies, obtained from DFT calculations, for the solvated ground (So) and excited states (S1) have been compared. Moreover, the in vitro cytotoxic activity of the chromophores has been examined against three human cancer cell lines and a human fibroblast line (WI38), using Sorafenib as a reference. The TPAT-CN chromophore displayed strong cytotoxic effectiveness towards HCT-116 and HepG2 cells (IC50 = 6.25 ± 0.36 and 9.44 ± 0.05 µM), while the TPAT-NO₂ analogue exhibited moderate effectiveness across the investigated cancer cells. In addition, the VEGFR-2 kinase inhibition efficacy revealed that both chromophores effectively inhibited VEGFR-2 enzymatic activity in the sub-micromolar range, where TPAT-CN IC50 = 0.53 ± 0.26 µM and TPAT-NO2 IC50 = 0.62 ± 0.11 µM. Finally, the molecular docking study was conducted against the VEGFR-2 receptor (PDB: 3WZE) and revealed promising binding affinity, superior Sorafenib.

本文报道了基于三苯胺(供体基)、噻吩(共轭桥)和芳基甲基亚胺(受体基)分子结构的新型D-π-A发色团的合成。目标发色团的合成途径是2-甲酰基-5-(4-(二苯基氨基)苯基)噻吩(5)与合适的受体(4-氰苯胺或4-硝基苯胺(TPAT-CN和TPAT-NO2)分别缩合。利用吸收光谱和荧光光谱以及其他光谱数据对新合成的发色团进行了表征。在DMSO中记录了发色团的吸收和发射光谱,并呈现出良好的Stokes位移([公式:见文]= 5505-5593 cm-1)。比较了溶剂化的基态(So)和激发态(S1)的FMOs图和能量。此外,以索拉非尼为对照,研究了发色团对三种人癌细胞系和一种人成纤维细胞系(WI38)的体外细胞毒活性。TPAT-CN发色团对HCT-116和HepG2细胞具有较强的细胞毒性(IC50分别为6.25±0.36和9.44±0.05µM),而TPAT-NO - 2类似物对所研究的癌细胞具有中等的毒性。此外,VEGFR-2激酶抑制效果显示,两种发色团在亚微摩尔范围内有效抑制VEGFR-2酶活性,其中TPAT-CN IC50 = 0.53±0.26µM, TPAT-NO2 IC50 = 0.62±0.11µM。最后,我们对VEGFR-2受体(PDB: 3WZE)进行了分子对接研究,发现其具有良好的结合亲和力,具有较强的索拉非尼优势。
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引用次数: 0
A Mesogenic Glycyl-L-tyrosine Based Schiff Base Probe for Selective Dual Analytes (Zn2+ and Cd2+) via Turn-on Fluorescence Responses and Its Application in Real Water Sample and Molecular Logic Gate. 基于glyyl - l-酪氨酸的选择性双分析物(Zn2+和Cd2+)的介源希夫碱探针及其在水样和分子逻辑门中的应用
IF 3.1 4区 化学 Q2 BIOCHEMICAL RESEARCH METHODS Pub Date : 2025-11-10 DOI: 10.1007/s10895-025-04614-2
Jagritima Chetia, Hunshisha Pyngrope, Bandashisha Kharpan, Amit Kumar Pradhan, Pradip C Paul

A noble highly selective, sensitive and SmA mesogenic dipeptide-based Schiff base ligand (HL) was synthesized and characterized using various instrumental and analytical techniques. The Schiff base ligand functions as a potent fluorescent chemosensor for the dual detection of Cd2+ and Zn2+ metal ions with the detection limits of 2.02 nM and 2.68 nM, respectively. Job's plot analysis revealed 2:1 stoichiometric ratio between the probe and the metal ions, with binding constant value of 3.25 × 106 M- 1 for Zn2+ and 5.20 × 106 M- 1 for Cd2+. The probe showed reversibility nature over four cycles through alternate addition of Zn2+/ Cd2+ and EDTA, exhibiting distinct off-on-off fluorescence, enabling construction of three molecular logic gates. The probe effectively detected Zn2+ and Cd2+ in real water samples over a broad pH range. The DFT study of the Schiff base and its complexes with Zn2+ and Cd2+ were performed using LanL2DZ and 6-31G(d, p) basis set with the hybrid correlation B3LYP to ascertain the optimized geometry.

合成了一种高选择性、高敏感性的SmA介生二肽基希夫碱配体(HL),并利用各种仪器和分析技术对其进行了表征。希夫碱配体是一种有效的荧光化学传感器,可对Cd2+和Zn2+金属离子进行双重检测,检测限分别为2.02 nM和2.68 nM。Job的图分析显示探针与金属离子的化学计量比为2:1,Zn2+的结合常数为3.25 × 106 M- 1, Cd2+的结合常数为5.20 × 106 M- 1。通过交替添加Zn2+/ Cd2+和EDTA,探针在4个周期内表现出可逆性,表现出明显的开关-关闭荧光,从而构建了3个分子逻辑门。该探针能在较宽的pH范围内有效检测实际水样中的Zn2+和Cd2+。采用LanL2DZ和6-31G(d, p)基,结合混合相关B3LYP,对Schiff碱及其与Zn2+和Cd2+配合物进行了DFT研究,确定了优化的几何结构。
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引用次数: 0
Direct Determination of the Environmental Contaminant Acid 2,4-diclorofenoxiacetic in Natural Waters by Solid Surface Fluorescence. 固体表面荧光法直接测定天然水体中环境污染物酸2,4-二氯芬氧乙酸。
IF 3.1 4区 化学 Q2 BIOCHEMICAL RESEARCH METHODS Pub Date : 2025-11-08 DOI: 10.1007/s10895-025-04629-9
Mariano Acosta, Perez Iglesias Juan M Fernández, Liliana P, Maria C Talio

2,4-Dichlorophenoxyacetic acid (2,4-D) is a selective, low-volatility, systemic herbicide. It is used to control broadleaf weeds in certain crops, such as rice, corn, and wheat. The use of 2,4-D has become widespread in both the agricultural and industrial sectors, with the serious drawback that 2,4-D residues can contaminate food, soil, and groundwater sources. It has been classified as a group 2B carcinogen by the International Agency for Research on Cancer. This paper proposes the development of a new alternative methodology to traditional techniques for the control and monitoring of 2,4-D in natural water samples from agricultural areas surrounding the Quinto River in the province of San Luis. The herbicide was quantified directly, in the presence of the anionic surfactant SDS, the systems were filtered through blue band filter paper as a solid support, prior to determination by solid surface fluorescence (SSF) (λexc = 555 nm; λem = 580 nm). Under optimal working conditions, a detection limit and a quantification limit of 0.33 and 0.90 ng L- 1, respectively, with a linearity range of 0.90 to 1.13 × 103 ng L- 1. The proposed methodology was applied to natural water samples from agricultural areas, adjacent to the Quinto River in the province of San Luis, representing an innovative alternative to conventional methods for 2,4-D monitoring. The concentrations found were near to 3 ng L- 1. Additionally, among the advantages of the new method, it is important to highlight the generation of low volumes of waste, preserving the environment and thus contributing to some principles of green chemistry.

2,4-二氯苯氧乙酸(2,4- d)是一种选择性、低挥发性、全身性除草剂。它被用来控制某些作物的阔叶杂草,如水稻、玉米和小麦。2,4- d的使用已经在农业和工业部门广泛使用,其严重的缺点是2,4- d残留会污染食物、土壤和地下水资源。它已被国际癌症研究机构列为2B类致癌物。本文提出了一种新的替代方法,用于控制和监测圣路易斯省昆图河周围农业区天然水样中的2,4- d。直接定量,在阴离子表面活性剂SDS存在下,用蓝带滤纸作为固体载体过滤,用固体表面荧光(SSF) (λexc = 555 nm; λem = 580 nm)测定。在最佳工作条件下,检测限和定量限分别为0.33和0.90 ng L- 1,线性范围为0.90 ~ 1.13 × 103 ng L- 1。所提出的方法应用于圣路易斯省昆图河附近农业区的天然水样,代表了传统的2,4- d监测方法的创新替代方案。所发现的浓度接近3 ng L- 1。此外,在新方法的优点中,重要的是要强调产生少量废物,保护环境,从而促进绿色化学的一些原则。
{"title":"Direct Determination of the Environmental Contaminant Acid 2,4-diclorofenoxiacetic in Natural Waters by Solid Surface Fluorescence.","authors":"Mariano Acosta, Perez Iglesias Juan M Fernández, Liliana P, Maria C Talio","doi":"10.1007/s10895-025-04629-9","DOIUrl":"https://doi.org/10.1007/s10895-025-04629-9","url":null,"abstract":"<p><p>2,4-Dichlorophenoxyacetic acid (2,4-D) is a selective, low-volatility, systemic herbicide. It is used to control broadleaf weeds in certain crops, such as rice, corn, and wheat. The use of 2,4-D has become widespread in both the agricultural and industrial sectors, with the serious drawback that 2,4-D residues can contaminate food, soil, and groundwater sources. It has been classified as a group 2B carcinogen by the International Agency for Research on Cancer. This paper proposes the development of a new alternative methodology to traditional techniques for the control and monitoring of 2,4-D in natural water samples from agricultural areas surrounding the Quinto River in the province of San Luis. The herbicide was quantified directly, in the presence of the anionic surfactant SDS, the systems were filtered through blue band filter paper as a solid support, prior to determination by solid surface fluorescence (SSF) (λ<sub>exc</sub> = 555 nm; λ<sub>em</sub> = 580 nm). Under optimal working conditions, a detection limit and a quantification limit of 0.33 and 0.90 ng L<sup>- 1</sup>, respectively, with a linearity range of 0.90 to 1.13 × 10<sup>3</sup> ng L<sup>- 1</sup>. The proposed methodology was applied to natural water samples from agricultural areas, adjacent to the Quinto River in the province of San Luis, representing an innovative alternative to conventional methods for 2,4-D monitoring. The concentrations found were near to 3 ng L<sup>- 1</sup>. Additionally, among the advantages of the new method, it is important to highlight the generation of low volumes of waste, preserving the environment and thus contributing to some principles of green chemistry.</p>","PeriodicalId":15800,"journal":{"name":"Journal of Fluorescence","volume":" ","pages":""},"PeriodicalIF":3.1,"publicationDate":"2025-11-08","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145471155","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
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Journal of Fluorescence
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