Synthesis and structural evaluation of organo-ruthenium complexes with ß-diketonates
ID Uršič, Matija (Author), ID Lipec, Tanja (Author), ID Meden, Anton (Author), ID Turel, Iztok (Author)

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Four novel ruthenium organometallic complexes: [(η$^6$-p-cymene)Ru(4,4,4-trifluoro-1-(4-bromophenyl)-1,3-butanedione)Cl] (1), [(η$^6$-p-cymene)Ru(4,4,4-trifluoro-1-(4-bromophenyl)-1,3-butanedione)pta]PF$_6$ (2), [(η$^6$-p-cymene)Ru(4,4,4-trifluoro-1-(4-iodophenyl)-1,3-butanedione)Cl] (3) and [(η$^6$-p-cymene)Ru(4,4,4-trifluoro-1-(4-iodophenyl)-1,3-butanedione)pta]PF$_6$ (4) were synthesized and characterized by elemental analysis, infrared (IR), UV-Vis, NMR and mass spectroscopy and single-crystal X-ray diffraction. The crystal structures and spectroscopic data were compared to the previously published complexes [(η$^6$-p-cymene)Ru(4,4,4-trifluoro-1-(4-chloro-phenyl)-1,3-butanedione)Cl] (5) and [(η$^6$-p-cymene)Ru(4,4,4-trifluoro-1-(4-chlorophenyl)-1,3-butanedione)pta]PF$_6$ (6). The pairs of complexes 1 and 3 as well as 2 and 4 are isostructural, with the former crystallizing in triclinic P-1 and the latter in monoclinic P2$_1$/c. The ruthenium(II) ion is found in a pseudo-octahedral “piano-stool” geometry in all compounds. Bond lengths and angles are consistent with other complexes of this type. Complexes 2 and 4 exhibit some moderate dynamic disorder. The lack of hydrogen bonding and major π-π interactions means that most of intramolecular interactions are fairly weak and involve halogen atoms present. This was further confirmed by $^1$H-NMR spectra, where a significant difference is observed only on the ligand near the halogen atom, following an expected trend. The combined data show that the difference in any activity depends substantially on the type of the ligand′s substituted halogen atom.

Keywords:organoruthenium complexes, ß-diketonate ligands, halogen substituents, 1, 3, 5-triazaphosphoadamantane (pta) ligand, disorder
Work type:Article
Typology:1.01 - Original Scientific Article
Organization:FKKT - Faculty of Chemistry and Chemical Technology
Publication status:Published
Publication version:Version of Record
Number of pages:12 str.
Numbering:Vol. 22, iss. 2, art. 326
PID:20.500.12556/RUL-131179 This link opens in a new window
ISSN on article:1420-3049
DOI:10.3390/molecules22020326 This link opens in a new window
COBISS.SI-ID:1537371075 This link opens in a new window
Publication date in RUL:23.09.2021
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Shortened title:Molecules
COBISS.SI-ID:18462981 This link opens in a new window


License:CC BY 4.0, Creative Commons Attribution 4.0 International
Description:This is the standard Creative Commons license that gives others maximum freedom to do what they want with the work as long as they credit the author.
Licensing start date:20.02.2017

Secondary language

Keywords:organorutenijevi kompleksi, ß-diketonatni ligandi, halogenski substituenti, 1, 3, 5-triazafosfoadamantan (pta) ligand, nered


Funder:ARRS - Slovenian Research Agency
Funding programme:Junior Researcher Grant

Funder:ARRS - Slovenian Research Agency
Project number:P1-0175
Name:Sinteza, struktura, lastnosti snovi in materialov

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