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

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Abstract
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.

Language:English
Keywords:organoruthenium complexes, ß-diketonate ligands, halogen substituents, 1, 3, 5-triazaphosphoadamantane (pta) ligand, disorder
Work type:Article (dk_c)
Tipology:1.01 - Original Scientific Article
Organization:FKKT - Faculty of Chemistry and Chemical Technology
Year:2017
Number of pages:12 str.
Numbering:Vol. 22, iss. 2, art. 326
UDC:546.96:547-316
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
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Downloads:22
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Record is a part of a journal

Title:Molecules
Shortened title:Molecules
Publisher:MDPI
ISSN:1420-3049
COBISS.SI-ID:18462981 This link opens in a new window

Document is financed by a project

Funder:ARRS - Agencija za raziskovalno dejavnost Republike Slovenije (ARRS)
Funding Programme:Junior Researcher Grant

Funder:ARRS - Agencija za raziskovalno dejavnost Republike Slovenije (ARRS)
Project no.:P1-0175
Name:Sinteza, struktura, lastnosti snovi in materialov

Licences

License:CC BY 4.0, Creative Commons Attribution 4.0 International
Link:http://creativecommons.org/licenses/by/4.0/
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

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

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