Tetra(1,2,5-thiadiazolo)porphyrazines. 10. Synthesis, spectral characterization and DFT study of complexes with yttrium(III) and lutetium(III)

被引：11
|
作者：
Tarakanova, Ekaterina N. [1 ]
Hamdoush, Mahmoud [1 ]
Eroshin, Alexey, V [1 ]
Ryzhov, Igor, V [1 ]
Zhabanov, Yuriy A. [1 ]
Stuzhin, Pavel A. [1 ]
机构：
[1] Ivanovo State Univ Chem & Technol, Res Inst Macroheterocycles, RF-153000 Ivanovo, Russia
来源：
POLYHEDRON | 2021年 / 193卷
基金：
俄罗斯科学基金会;
关键词：
Porphyrazines; 1,2,5-thiadiazole; Yttrium; Lutetium; Mass-spectra; UV-VIS; DFT study; RARE-EARTH-ELEMENTS; LANTHANIDE COMPLEXES; ELECTRONIC-STRUCTURE; 1ST EXAMPLE; CU-II; ZN-II; TETRAKIS(THIADIAZOLE)PORPHYRAZINES; SEMICONDUCTOR; ELECTROCHEMISTRY; POLARIZATION;
D O I：
10.1016/j.poly.2020.114877
中图分类号：
O61 [无机化学];
学科分类号：
070301 ; 081704 ;
摘要：
First complexes of tetra(1,2,5-thiadiazolo)porphyrazine with representatives of rare earth elements [TSDPzM(acac)] (M = Y and Lu) were prepared by complexation of the metal free macrocycle [TSDPzH(2)] with Y-III and Lu-III acetylacetonates in o-dichlorobenzene in the presence of DBU. The obtained complexes were characterized by MALDI-TOF mass-spectrometry, IR spectroscopy and by electronic absorption and fluorescence emission spectra. The DFT calculations performed for the model complexes [TSDPzM(Cl)] evidence that coordination of Y and Lu leads to considerable doming deformation of the TSDPz macrocycle and were used for the assignment of the characteristic bands observed in the experimental IR spectra. (C) 2020 Elsevier Ltd. All rights reserved.
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