A Triazolate-Supported Fe3(μ 3 -O) Core: Crystal Structure, Fluorescence, and Hirshfeld Surface Analysis

被引:8
|
作者
Feng, Chao [1 ]
Zhu, Yu-Qing [1 ]
Xue, Xing-Ying [1 ]
Zhao, Hong [1 ]
机构
[1] Southeast Univ, Sch Chem & Chem Engn, Nanjing 211189, Jiangsu, Peoples R China
基金
中国国家自然科学基金;
关键词
Fe(III) cluster; Crystal structure; Fluorescence; Hirshfeld surface analysis; LONE PAIR-PI; INTERMOLECULAR INTERACTIONS; MAGNETIC-PROPERTIES; WEAK FORCES; X-RAY; MOLECULAR-STRUCTURE; TERNARY-SYSTEM; COMPLEXES M; ANION-PI; CLUSTER;
D O I
10.1007/s10876-016-0989-8
中图分类号
O61 [无机化学];
学科分类号
070301 ; 081704 ;
摘要
One new trinuclear Fe(III) cluster with a Fe-3(mu (3)-O) core was synthesized by the method of hydrothermal synthesis. The complex [Fe-3(mu (3)-O)(pmta)(6)(H2O)(3)]FeCl4 center dot 2H(2)O (1) (where Hpmta is 5-methyl-1-phenyl-1H-1,2,3-triazole-4-carboxylic acid) was characterized by single-crystal X-ray diffraction methods, elemental analyses, IR spectroscopy, fluorescence and Hirshfeld surface analysis. For complex 1, the crystal structure is extended into 3D structure through N-H center dot center dot center dot O and O-H center dot center dot center dot O hydrogen bonds. According to the 3D Hirshfeld surface and 2D fingerprint plots, the main interactions in the cluster are the H center dot center dot center dot H, N center dot center dot center dot H and C center dot center dot center dot H contacts.
引用
收藏
页码:1181 / 1190
页数:10
相关论文
共 50 条
  • [21] Crystal structure and Hirshfeld surface analysis of (E)-3-benzylidene-4-oxopentanoic acid
    Assila, Hamza
    Zaoui, Younes
    El Hassani, Issam Ameziane
    El Ghammarti, Samira
    Mague, Joel T.
    Taoufik, Jamal
    Ramli, Youssef
    Ansar, Mhammed
    ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2022, 78 : 563 - +
  • [22] Crystal structure and Hirshfeld surface analysis of 4-(4-methylbenzyl)-6-phenylpyridazin-3(2H)-one
    Daoui, Said
    Cinar, Emine Berrin
    El Kalai, Fouad
    Saddik, Rafik
    Karrouchi, Khalid
    Benchat, Noureddine
    Baydere, Cemile
    Dege, Necmi
    ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2019, 75 : 1352 - +
  • [23] 3-Pyrazolyl-pyran-2-one: Synthesis, crystal structure, Hirshfeld surface analysis, DFT and ADME studies
    Ouhaddou, Madani
    Bouissane, Latifa
    Zazouli, Sofia
    Jouffret, Laurent
    Hafid, Abderrafia
    Khouili, Mostafa
    Ketatni, El Mostafa
    JOURNAL OF MOLECULAR STRUCTURE, 2024, 1316
  • [24] (E)-1-(2,6-Dichlorophenyl)-2-(3-nitrobenzylidene)hydrazine: crystal structure and Hirshfeld surface analysis
    Atioglu, Zeliha
    Akkurt, Mehmet
    Shikhaliyev, Namiq Q.
    Suleymanova, Gulnar T.
    Babayeva, Gulnare, V
    Gurbanova, Nurana, V
    Mammadova, Gunay Z.
    Mlowe, Sixberth
    ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2020, 76 : 1291 - +
  • [25] Crystal structure elucidation, Hirshfeld surface analysis, and DFT studies of a N-benzyl-3-phenylquinoxalin-2-amine
    Akhileshwari, P.
    Kiran, K. R.
    Sridhar, M. A.
    Sadashiva, M. P.
    JOURNAL OF MOLECULAR STRUCTURE, 2022, 1253
  • [26] Crystal structure and Hirshfeld surface analysis of the orthorhombic polymorph of a ZnII complex with 3,5-dinitrobenzoic acid and ethylenediamine
    Ibragimov, Avazbek
    Ashurov, Jamshid
    Dusmatov, Aziz
    Ibragimov, Aziz
    ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2020, 76 : 1113 - +
  • [27] Crystal structure of LaSr3Fe3O9 and its phase relation with LaSr3Fe3O10
    Fjellvag, Stein S.
    Oygarden, Vegar
    Sorby, Magnus H.
    Sjastad, Anja O.
    JOURNAL OF SOLID STATE CHEMISTRY, 2019, 275 : 56 - 62
  • [28] Understanding the structure of salicyl hydrazone metallocomplexes: crystal structure, AIM and Hirshfeld surface analysis of trichloro-(N-salicylidenebenzoylhydrazinato-N,O,O')-tin(IV)
    Korlyukov, Alexander A.
    Shmatkova, Natalia V.
    Seifullina, Inna I.
    Vologzhanina, Anna V.
    STRUCTURAL CHEMISTRY, 2016, 27 (01) : 25 - 36
  • [29] 1,2,4-triazole-3-thione Schiff bases compounds: Crystal structure, hirshfeld surface analysis, DFT studies and biological evaluation
    Wu, Shaojie
    Qi, Le
    Ren, Yinghui
    Ma, Haixia
    JOURNAL OF MOLECULAR STRUCTURE, 2020, 1219
  • [30] Crystal structure and Hirshfeld surface analysis of 3-[2-(3,5-dimethylphenyl)hydrazinylidene]benzofuran-2(3H)-one
    Atioglu, Zeliha
    Akkurt, Mehmet
    Shikhaliyev, Namiq Q.
    Askerova, Ulviyya F.
    Mukhtarova, Sevinc H.
    Askerov, Rizvan K.
    Bhattarai, Ajaya
    ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2021, 77 : 1280 - +