Weak Exchange Interactions in Multispin Systems: EPR Studies of Metalloporphyrins Decorated with {Cr7Ni} Rings

IF 4.3 2区 化学 Q1 CHEMISTRY, INORGANIC & NUCLEAR Inorganic Chemistry Pub Date : 2024-06-28 DOI:10.1021/acs.inorgchem.4c01248
Fabio Santanni, Edmund Little, Selena J. Lockyer, George F. S. Whitehead, Eric J. L. McInnes, Grigore A. Timco, Alice M. Bowen, Roberta Sessoli, Richard E. P. Winpenny
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Abstract

Both metalloporphyrins and heterometallic {Cr7Ni} rings are of significant research interest due to their proposed roles in quantum information processing devices. In this study, we present a series of complexes in which [Cr7NiF3(Etglu)(O2CtBu)15] (N-EtgluH5 = N-ethyl-d-glucamine) heterometallic rings are coordinated to metalloporphyrin linkers: the symmetric [M(TPyP)] for M = Cu2+, VO2+, and H2TPyP = 5,10,15,20-tetra(4-pyridyl)porphyrin; and the asymmetric [{VO}(TrPPyP)] for H2(TrPPyP) = 5,10,15-(triphenyl)-20-(4-pyridyl)porphyrin. The magnetic interactions present in these complexes are unraveled using the continuous wave (CW) electron paramagnetic resonance (EPR) technique. The nature of the coupling between the {Cr7Ni} rings and the central metalloporphyrin is assessed by numerical simulations of CW EPR spectra and determined to be on the order of 0.01 cm–1, larger than the dipolar ones and suitable for individual spin addressability in multiqubit architectures.

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多卟啉体系中的弱交换相互作用:用 {Cr7Ni} 环装饰的金属卟啉的 EPR 研究环
金属卟啉和杂金属{Cr7Ni}环因其在量子信息处理设备中的作用而备受研究关注。在本研究中,我们提出了一系列[Cr7NiF3(Etglu)(O2CtBu)15](N-EtgluH5 = N-乙基-d-葡萄糖胺)杂金属环与金属卟啉连接体配位的配合物:M = Cu2+、VO2+ 和 H2TPyP = 5,10,15,20-四(4-吡啶基)卟啉的对称[M(TPyP)];以及 H2(TrPPyP) = 5,10,15-(三苯基)-20-(4-吡啶基)卟啉的不对称[{VO}(TrPPyP)]。利用连续波(CW)电子顺磁共振(EPR)技术揭示了这些复合物中存在的磁性相互作用。通过对连续波电子顺磁共振光谱进行数值模拟,评估了{Cr7Ni}环和中心金属卟啉之间耦合的性质,并确定其耦合度为 0.01 cm-1,大于偶极耦合度,适用于多量子位架构中的单个自旋寻址。
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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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