www.elsevier.nl/locate/ica Inorganica Chimica Acta 290 (1999) 247 – 250 Note Five-coordinate rhenium(III)-thiolato complexes: the structure of [Re(SCH 2 PhOCH 3 ) 3 (PPh 3 ) 2 ] M.S. Papadopoulos a , P. Bouziotis a , I.C. Pirmettis a , C.P. Raptopoulou b , A. Terzis b , E. Chiotellis a, * a Institute of Radioisotopes -Radiodiagnostic Products, NCSR Demokritos, PO Box 60228, 15310, Aghia Paraskei, Athens, Greece b Institute of Materials Science, NCSR Demokritos, PO Box 60228, 15310, Aghia Paraskei, Athens, Greece Received 10 December 1998; accepted 9 March 1999 Abstract A novel five-coordinate rhenium(III)-thiolato complex, Re(SCH 2 C 6 H 4 OCH 3 -p ) 3 (PPh 3 ) 2 has been isolated during the reaction of trans -ReOCl 3 (PPh 3 ) 2 with p -methoxybenzyl mercaptan. In the unexpected structure that was acquired, the central metal has undergone a reduction from Re(V) to Re(III). The five-coordinate Re(III) complex has been characterized by spectroscopic methods, elemental analysis and X-ray crystallography. X-ray crystallographic studies showed the coordination geometry around rhenium to be that of a trigonal bipyramid. The basal plane is defined by three sulfur atoms of the monodentate ligand, while the two apical positions are occupied by two phosphines of the precursor. © 1999 Elsevier Science S.A. All rights reserved. Keywords: Crystal structures; Rhenium complexes; Thiolato complexes; Five-coordinate complexes 1. Introduction The coordination chemistry of technetium and rhe- nium has attracted much attention due to the wide- spread use of 99m Tc in diagnostic imaging and 186 Re and 188 Re in radiotherapy [1]. Rhenium is technetium’s third row congener, thus exhibiting similar chemical properties to technetium. Minor chemical differences between complexes of these two isotopes can result in different biological behavior. The most pronounced of these is the redox potential of the central metal. Com- plexes of rhenium are more difficult to reduce than the analogous technetium complexes [2]. As part of our investigations into thiolato complexes of rhenium, we have looked into the side products of different reaction systems involving a variety of thiols as coligands [3–6]. In the course of a systematic study, we reacted trans -ReOCl 3 (PPh 3 ) 2 with an excess of p - methoxybenzyl mercaptan, p -CH 3 OC 6 H 4 CH 2 SH. Sur- prisingly, we obtained a complex with the unexpected structure [Re(SCH 2 C 6 H 4 OCH 3 -p ) 3 (PPh 3 ) 2 ], where the central rhenium atom had undergone a reduction from Re(V) to Re(III). So far, the acquisition of pentacoordi- nate Re(III) complexes has been described in the litera- ture only a few times [7,8]. The Re(III) products might be thermodynamically more stable, thus more favorable than the Re(V) products [9]. This report presents the complex [Re(SCH 2 C 6 H 4 - OCH 3 -p ) 3 (PPh 3 ) 2 ] as the major reaction product, while among the minor products we can find the pentavalent Re(V) anion [ReO(SCH 2 C 6 H 4 OCH 3 -p ) 4 ] - , where the central metal is surrounded by four thiolato groups. 2. Experimental 2.1. Materials and methods IR spectra were recorded as KBr pellets in the range 4000–500 cm -1 on a Perkin-Elmer 1600 FT-IR spec- * Corresponding author. Tel.: +30-1-651 3793; fax: +30-1-654 3526. E-mail address: mainathe@cyclades.nrcps.ariadne-t.gr (E. Chiotel- lis) 0020-1693/99/$ - see front matter © 1999 Elsevier Science S.A. All rights reserved. PII:S0020-1693(99)00143-7