Citation: Ji-Ming WANG, Qian-Jun DENG, Shu-Hua ZHANG. Micro-vial Synthesis, Structure, Magnetic Properties and Hirshfeld Surface Analysis of a Penta-nuclear Fe(III) Cluster[J]. Chinese Journal of Structural Chemistry, ;2020, 39(1): 118-125. doi: 10.14102/j.cnki.0254-5861.2011-2395 shu

Micro-vial Synthesis, Structure, Magnetic Properties and Hirshfeld Surface Analysis of a Penta-nuclear Fe(III) Cluster

Ji-Ming WANG ^a ,
Qian-Jun DENG ^{a, b,,} ,
Shu-Hua ZHANG ^a,,

a.
College of Chemistry and Bioengineering (Guangxi Key Laboratory of Electrochemical and Magnetochemical Functional Materials), Guilin University of Technology, Guilin 541004, China
b.
School of Material Science and Energy Engineering, Foshan University, Foshan 528000, China

Corresponding author: Qian-Jun DENG, dqj39@163.com Shu-Hua ZHANG, zsh70108@163.com
Received Date: 4 April 2019
Accepted Date: 26 August 2019

Fund Project: the National Natural Science Foundation of China 21861014Program of the Collaborative Innovation Center for Exploration of Hidden Nonferrous Metal Deposits and Development of New Materials in Guangxi gxysxtzx2017-II-3

Figures(5)

A new penta-nuclear Fe^III cluster, [HN(C₂H₅)₃]·[Fe₅(timb)₄(ATZ)₄(μ₃-O)₂]·(H₂O)₅ (1), (H₂timb is 4-bromo-2-[(1H-tetrazol-5-ylimino)-methyl]-phenol; HATZ is 5-amino-1, 2, 3, 4-tetrazole), was synthesized through micro-vial synthesis methods, which was characterized by elemental analysis, FT-IR spectra, X-ray single-crystal diffraction, thermogravimetric analysis. The single crystal belongs to the tetragonal system, space group I\begin{document}$ \bar 4 $\end{document}2d with a = 0.19735(1), b = 0.19735(1), c = 0.26118(2) nm, M_r = 1904.04, V = 10.1724(10) nm³, Z = 4, D_c = 1.118 g/cm³, F(000) = 3356, μ = 2.314 mm^–1, R = 0.0500 and wR = 0.1151. The magnetic properties and Hirshfeld surface analysis of 1 were investigated and discussed in detail.
- penta-nuclear Fe(III) cluster,
- micro-vial reaction,
- Hirshfeld surface analysis,
- magnetic properties
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