Ferrocene Chalcone Enhanced Cyclotriphosphazene Photodiode Systems via Click Chemistry: Their Synthesis, Electrical, and Photophysical Properties

IF 4.7 2区 化学 Q1 CHEMISTRY, INORGANIC & NUCLEAR Inorganic Chemistry Pub Date : 2024-10-22 DOI:10.1021/acs.inorgchem.4c03376
M-Mahdi Kattan, Ferhan Sultan Şeker, Rümeysa Çetiner, Mücahit Özdemir, Fatih Biryan, Kenan Koran
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Abstract

In this study, a new ferrocene-decorated cyclotriphosphazene compound (4) was obtained by the interaction of ferrocene chalcone with azide end groups (2) and spirophosphazene (3) bearing alkyne groups using the click method. The structures of all compounds were confirmed using Fourier transform infrared, 1H, 13C APT, and 31P NMR, and MS techniques. The optical band gaps of compounds were measured, showing values of 4.75 eV for 3, 3.53 eV for 2, and 3.46 eV for final product 4. The optical band gap of compound 4 calculated by density functional theory is 3.28 eV. The electrical properties of the compounds were investigated against the frequency. The results showed that the conduction mechanism is based on the hopping model. New types of diodes were prepared by using compounds 2 and 4. The current–voltage characteristics of the compound 4 diode showed good rectification behavior. The rectification ratio of the heterojunction diode was calculated as 629. The ideality factors were 3.35 for 2 and 7.57 for 4. The barrier heights were 0.68 and 0.92, respectively. Under sunlight (20–100 mW/cm2), both diodes exhibited photodiode properties, with compound 4 being more sensitive to light. This indicates that the diodes can be used in optoelectronic devices due to their photoconductive behavior.

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二茂铁查耳酮通过点击化学增强的环三唑磷光电二极管系统:它们的合成、电学和光物理性质
本研究采用点击法,通过二茂铁查尔酮与叠氮末端基团(2)和含炔基的螺膦烯(3)的相互作用,获得了一种新的二茂铁装饰环三膦烯化合物(4)。所有化合物的结构都通过傅立叶变换红外光谱、1H、13C APT 和 31P NMR 以及 MS 技术得到了确认。对化合物的光带隙进行了测量,结果显示 3、2 和最终产物 4 的光带隙分别为 4.75 eV、3.53 eV 和 3.46 eV。用密度泛函理论计算出的化合物 4 的光带隙为 3.28 eV。研究了化合物的电学特性与频率的关系。结果表明,其传导机制是基于跳频模型。利用化合物 2 和 4 制备了新型二极管。化合物 4 二极管的电流-电压特性显示出良好的整流特性。经计算,异质结二极管的整流比为 629。化合物 2 和化合物 4 的意向系数分别为 3.35 和 7.57。势垒高度分别为 0.68 和 0.92。在阳光下(20-100 mW/cm2),两种二极管都表现出光电二极管的特性,化合物 4 对光更为敏感。这表明,由于其光电导行为,这些二极管可用于光电器件。
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来源期刊
Inorganic Chemistry
Inorganic Chemistry 化学-无机化学与核化学
CiteScore
7.60
自引率
13.00%
发文量
1960
审稿时长
1.9 months
期刊介绍: Inorganic Chemistry publishes fundamental studies in all phases of inorganic chemistry. Coverage includes experimental and theoretical reports on quantitative studies of structure and thermodynamics, kinetics, mechanisms of inorganic reactions, bioinorganic chemistry, and relevant aspects of organometallic chemistry, solid-state phenomena, and chemical bonding theory. Emphasis is placed on the synthesis, structure, thermodynamics, reactivity, spectroscopy, and bonding properties of significant new and known compounds.
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