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Crystal structure of bis(ethylenedithio)tetrathiafulvalenium μ2-acetato-bis[tribromidorhenate(III)] 1,1,2-trichloroethane hemisolvate

Authors :
Vladimir A. Starodub
A. V. Shtemenko
Denis M. Chudak
Alexander A. Golichenko
Irina V. Omelchenko
Bolesław Barszcz
Andrey V. Kravchenko
Source :
Acta Crystallographica Section E: Crystallographic Communications, Vol 72, Iss 5, Pp 712-715 (2016), Acta Crystallographica Section E: Crystallographic Communications
Publication Year :
2016
Publisher :
International Union of Crystallography, 2016.

Abstract

The crystal structure of a binuclear mono­carboxyl­ato dirhenium(III) complex with a fulvalene derivative is reported. This compound represents a radical cation salt containing a cluster unit with rhenium–rhenium quadruple bond.<br />The asymmetric unit of the title salt, (C10H8S8)[Re2Br6(CH3COO)]·0.5C2H3Cl3, contains one bis­(ethyl­enedi­thio)­tetra­thia­fulvalene (ET) radical cation, one μ2-acetato-bis­[tri­bromido­rhenate(III)] anion and a 1,1,2-tri­chloro­ethane mol­ecule with half-occupancy disordered about a twofold rotation axis. The tetra­thia­fulvalene fragment adopts an almost planar configuration typical of the ET radical cation. The C atoms of both ethyl­enedi­thio fragments in the cation are disordered over two orientations with occupancy factors 0.65:0.35 and 0.77:0.23. In the anion, six Br atoms and a μ2-acetate ligand form a strongly distorted cubic O2Br6 coordination polyhedron around the Re2 dinuclear centre. In the crystal, centrosymmetrically related ET cations and Re2O2Br6 anions are linked into dimers by π–π stacking inter­actions [centroid-to-centroid distance = 3.826 (8) Å] and by pairs of additional Re⋯Br contacts [3.131 (3) Å], respectively. The dimers are further packed into a three-dimensional network by non-directional inter­ionic electrostatic forces and by C—H⋯Br and C—H⋯S hydrogen bonds. The disordered 1,1,2-tri­chloro­ethane mol­ecules occupy solvent-accessible channels along the b axis.

Details

Language :
English
ISSN :
20569890
Volume :
72
Issue :
5
Database :
OpenAIRE
Journal :
Acta Crystallographica Section E: Crystallographic Communications
Accession number :
edsair.doi.dedup.....52d0a2f7d68275c5ee91261330e2c86e