哌嗪衍生的杂性Cd(II)硅硫代酸酯:结构见解、烯丙醇寡聚反应的催化活性和CO2吸附特性

IF 3.7 2区 化学 Q2 CHEMISTRY, APPLIED
Daria Kowalkowska-Zedler, Joanna Drzeżdżon, Anna Dołęga, Renata Łyszczek, Piotr Bruździak, Zbigniew Hnatejko, Bartosz Cieśla, Anna Gołąbiewska, Dagmara Jacewicz, Agnieszka Pladzyk
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引用次数: 0

摘要

哌嗪(ppz)和1-(2-氨基乙基)哌嗪(amppz)与[Cd{SSi (OtBu)3}2(amppz)]2·6CH3OH 1、双核[(μ-amppz)[Cd{SSi (OtBu)3}2·CH3OH}] 2和多核[Cd{SSi (OtBu)3}2(μ-ppz)]n 3在不同的试剂摩尔比下反应得到了三个新的配合物:单核[Cd{SSi (OtBu)3}2(amppz)] 1。所获得的化合物的性质表征使用广泛的技术:单晶x射线衍射,FTIR和UV-Vis光谱,TG和DSC分析。理论计算使用密度泛函理论(DFT)来优化分子几何形状,辅以非共价相互作用(NCI)分析来绘制关键的分子间力。模拟了红外光谱和紫外可见光谱以支持实验表征。发光研究表明,晶体1-3在室温下表现出双发射,归因于配体内转变。进一步研究了化合物1在MAO作为活化剂存在下的潜在CO2吸附和烯丙醇低聚反应。迄今为止,文献中尚未描述在烯丙醇聚合中使用任何镉(II)化合物。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Piperazine-Derived Heteroleptic Cd(II) Silanethiolates: Structural Insights, Catalytic Activity in Allyl Alcohol Oligomerization, and CO2 Sorption Properties

Three new complexes—mononuclear [Cd{SSi (OtBu)3}2(amppz)]2⋅6CH3OH 1, binuclear [(μ-amppz)[Cd{SSi (OtBu)3}][{Cd{SSi (OtBu)3}2·CH3OH}] 2, and polynuclear [Cd{SSi (OtBu)3}2(μ-ppz)]n 3—have been obtained in the reaction of piperazine (ppz) and 1-(2-aminoethyl)piperazine (amppz) with [Cd{SSi (OtBu)3}2]2 in diverse molar ratios of the reagents. Characterization of the properties of the obtained compounds was performed using a broad range of techniques: single-crystal X-ray diffraction, FTIR and UV–Vis spectroscopy, TG, and DSC analysis. Theoretical calculations were performed using density functional theory (DFT) to optimize molecular geometries, complemented by noncovalent interaction (NCI) analysis to map key intermolecular forces. IR and UV–Vis spectra were also simulated to support the experimental characterization. Luminescence studies have shown that crystalline 13 exhibit dual emission at room temperature ascribed to the intraligand transition. Compound 1 was further investigated for potential CO2 sorption and initiation of allyl alcohol oligomerization in the presence of MAO as the activator of the process. To date, the use of any cadmium(II) compounds in the polymerization of allyl alcohol has not been described in the literature.

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来源期刊
Applied Organometallic Chemistry
Applied Organometallic Chemistry 化学-无机化学与核化学
CiteScore
7.80
自引率
10.30%
发文量
408
审稿时长
2.2 months
期刊介绍: All new compounds should be satisfactorily identified and proof of their structure given according to generally accepted standards. Structural reports, such as papers exclusively dealing with synthesis and characterization, analytical techniques, or X-ray diffraction studies of metal-organic or organometallic compounds will not be considered. The editors reserve the right to refuse without peer review any manuscript that does not comply with the aims and scope of the journal. Applied Organometallic Chemistry publishes Full Papers, Reviews, Mini Reviews and Communications of scientific research in all areas of organometallic and metal-organic chemistry involving main group metals, transition metals, lanthanides and actinides. All contributions should contain an explicit application of novel compounds, for instance in materials science, nano science, catalysis, chemical vapour deposition, metal-mediated organic synthesis, polymers, bio-organometallics, metallo-therapy, metallo-diagnostics and medicine. Reviews of books covering aspects of the fields of focus are also published.
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