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
  • [31] 3-Benzyloxybenzaldehyde: Ab initio powder structure determination and Hirshfeld surface analysis
    Das, Uday
    Chattopadhyay, Basab
    Mukherjee, Monika
    Mukherjee, Alok K.
    ZEITSCHRIFT FUR KRISTALLOGRAPHIE-CRYSTALLINE MATERIALS, 2013, 228 (11): : 583 - 589
  • [32] Synthesis, crystal structure determination and Hirshfeld surface analysis of three new salt forms of creatinine with hydrobromic acid, 3-aminobenzoic acid and 3,5-dinitrobenzoic acid
    Selvaraj, Nirmalram Jeyaraman
    Sathya, Udhayasuriyan
    Gomathi, Sundaramoorthy
    Jennifer, Samson Jegan
    Mathivathanan, Logesh
    Razak, Ibrahim Abdul
    ACTA CRYSTALLOGRAPHICA SECTION C-STRUCTURAL CHEMISTRY, 2022, 78 : 437 - +
  • [33] Crystal structure, Hirshfeld surface analysis and density functional theory study of 1-nonyl-3-phenylquinoxaim-2-one
    Abad, Nadeem
    Chkirate, Karim
    Al-Ostoot, Fares Hezam
    Van Meervelt, Luc
    Lahmidi, Sanae
    Ferfra, Souad
    Ramli, Youssef
    Essassi, El Mokhtar
    ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2021, 77 : 1037 - +
  • [34] N,N′-Bis(pyridin-3-ylmethyl)ethanediamide monohydrate: crystal structure, Hirshfeld surface analysis and computational study
    Tan, Sang Loon
    Tiekink, Edward R. T.
    ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2020, 76 : 25 - +
  • [35] Crystal structure and Hirshfeld surface analysis of 2-(1H-indol-3-yl)ethanaminium acetate hemihydrate
    Rajeswari, Balakrishnan
    Santhi, Radhakrishnan
    Siyajeyanthi, Palanivappan
    Balasubramani, Kasthuri
    ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2019, 75 : 451 - +
  • [36] Synthesis, crystal structure and Hirshfeld surface analysis of 2-chloro-3-[(E)-(2-phenylhydrazinylidene)methyl]quinoline
    Akhramez, Soufiane
    Hafid, Abderrafia
    Khouili, Mostafa
    Saadi, Mohamed
    El Ammari, Lahcen
    Ketatni, El Mostafa
    ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2019, 75 : 964 - +
  • [37] Crystal structure, Hirshfeld surface analysis and DFT studies of N-(4-acetylphenyl)quinoline-3-carboxamide
    Polo-Cuadrado, Efrain
    Ferrer, Karoll
    Osorio, Edison
    Brito, Ivan
    Cisterna, Jonathan
    Gutierrez, Margarita
    JOURNAL OF MOLECULAR STRUCTURE, 2021, 1246 (1246)
  • [38] Crystal structure and Hirshfeld surface analysis of 1-(tert-butylamino)-3-mesitylpropan-2-ol hemihydrate
    Khalilov, Ali N.
    Khrustalev, Victor N.
    Tereshina, Tatiana A.
    Akkurt, Mehmet
    Rzayev, Rovnag M.
    Akobirshoeva, Anzurat A.
    Mamedov, Ibrahim G.
    ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2022, 78 : 525 - +
  • [39] Crystal structures and Hirshfeld surface analysis of (cat)2[FeIII(η3-dipic)(NCS)3] and (cat)[FeIII(η3-dipic)(H2O)(NCS)2] (dipic = dipicolinate)
    Koman, Marian
    Melnik, Milan
    Uhrecky, Robert
    Moncol, Jan
    POLYHEDRON, 2020, 183
  • [40] Crystal structure and Hirshfeld surface analysis of 3-(hydroxymethyl)-3-methyl-2,6-diphenylpiperidin-4-one
    Gumus, Mustafa Kemal
    Kansiz, Sevgi
    Tulemisova, Gulzhamal Bagitovna
    Dege, Necmi
    Saif, Eiad
    ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2022, 78 : 29 - +