SYNTHESIS, CRYSTAL STRUCTURE, OPTICAL AND ANTIMICROBIAL PROPERTIES OF 2-NITROBENZYL TRIPHENYLPHOSPHONIUM TETRABROMOCOBALTATE(II)

Y.-T. Li, L. Huang, Znang Wen, M.-T. Zhu, X.-T. Zheng, Z.-H. Zhang, Z. Wang, Chun-Lin Ni
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Abstract

A novel organic-inorganic hybrid multifunctional crystalline material, 2-nitrobenzyl triphenylphosphonium tetrabromocobaltate(II) [2-NO2BzTPP]2[CoBr4](1), has been synthesized using [2-NO2BzTPP]Br and CoBr2 in methanol solution acidified with hydrobromic acid and characterized using single-crystal X-ray diffraction and spectroscopic techniques. The single-crystal X-ray diffraction analysis showed that the hybrid [2-NO2BzTPP]2[CoBr4](1) belongs to the triclinic space group P–1 with a = 11.1815(17) Å, b = 12.954(2) Å, c = 19.426(3) Å, α = 99.312(5)°, β = 100.654(5)°, γ = 113.746(5)°, V = 2442.3(7) Å3, Z = 2, which consists of two [2-NO2BzTPP]+ cations and a [CoBr4]2– anion. The Co(II) ion in the [CoBr4]2– anion is coordinated to four Br– ions and has a tetrahedral geometry. The C–H···O hydrogen bonds, O···π and O···Br interactions in the crystal can favor crystal stacking and stabilization. The bulk phase purity, homogeneity, and morphology of the desired compound are checked using powder XRD, and SEM-EDX analysis. The hybrid crystal showed an emission peak near 468 nm at room temperature under the excitation of UV light at 241 nm. The low energy gap (2.85 eV) indicated that the crystal was a semiconductor suitable for optical applications. Furthermore, the compound exhibited good bactericidal activity against E. coli and S. aureus.
2-nitrobenzyl triphenylphosphonium tetrabromocobaltate(ii) 的合成、晶体结构、光学和抗菌特性
利用[2-NO2BzTPP]Br 和 CoBr2 在氢溴酸酸化的甲醇溶液中合成了一种新型有机-无机杂化多功能晶体材料--2-硝基苄基三苯基膦四溴钴酸盐(II)[2-NO2BzTPP]2[CoBr4](1),并利用单晶 X 射线衍射和光谱技术对其进行了表征。单晶 X 射线衍射分析表明,混合物 [2-NO2BzTPP]2[CoBr4](1) 属于三菱空间群 P-1,a = 11.1815(17) Å,b = 12.α = 99.312(5)°,β = 100.654(5)°,γ = 113.746(5)°,V = 2442.3(7) Å3,Z = 2,由两个 [2-NO2BzTPP]+ 阳离子和一个 [CoBr4]2- 阴离子组成。CoBr4]2- 阴离子中的 Co(II) 离子与四个 Br- 离子配位,呈四面体几何形状。晶体中的 C-H-O 氢键、O--π 和 O-Br 相互作用有利于晶体的堆积和稳定。利用粉末 XRD 和 SEM-EDX 分析检测了所需化合物的体相纯度、均匀性和形态。在 241 纳米紫外光的激发下,杂化晶体在室温下显示出 468 纳米附近的发射峰。低能隙(2.85 eV)表明该晶体是一种适合光学应用的半导体。此外,该化合物对大肠杆菌和金黄色葡萄球菌具有良好的杀菌活性。
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