The Use of a Vanadium Species As a Catalyst in Photoinduced Water Oxidation Marie-Pierre Santoni,* , Giuseppina La Ganga, Viviana Mollica Nardo, Mirco Natali, Fausto Puntoriero, Franco Scandola,* , and Sebastiano Campagna* ,,§ Dipartimento di Scienze Chimiche, Universita ̀ di Messina, and Centro Interuniversitario per la Conversione Chimica dellEnergia Solare (SOLAR-CHEM), sezione di Messina, 98166 Messina, Italy Dipartimento di Scienze Chimiche e Farmaceutiche, Universita ̀ di Ferrara, and Centro Interuniversitario per la Conversione Chimica dellEnergia Solare (SOLAR-CHEM), sezione di Ferrara, 44121 Ferrara, Italy § ISOF-CNR, 40129 Bologna, Italy * S Supporting Information ABSTRACT: The rst water oxidation catalyst containing only vanadium atoms as metal centers is reported. The compound is the mixed-valence [(V IV 5 V V 1 )O 7 (OCH 3 ) 12 ] - species, 1. Photoinduced water oxidation catalyzed by 1, in the presence of Ru(bpy) 3 2+ (bpy = 2,2-bipyridine) and Na 2 S 2 O 8 , in acetonitrile/aqueous phosphate buer takes place with a quantum yield of 0.20. A hole scavenging reaction between the photochemically generated Ru- (bpy) 3 3+ and 1 occurs with a bimolecular rate constant of 2.5 × 10 8 M -1 s -1 . The time-resolved formation of the oxidized molecular catalyst 1 + in bimolecular reactions is also evidenced for the rst time by transient absorption spectroscopy. This result opens the way to the use of less expensive vanadium clusters as water oxidation catalysts in articial photosynthesis schemes. A rticial photosynthesis, that is the conversion of light energy into chemical energy, is currently attracting much interest, for both fundamental and applicative reasons. 1-5 The achievement of an ecient articial photosynthesis, aimed to produce high-energy content chemical species from low-energy content chemical species using solar energy as the energy source, would be a sort of Holy Grail of modern science, 2 as it could solve the problems connected with the intermittency and low-density of solar energy. 4,5 Moreover, solar energy is diuse all over the world, and the social and political problems somehow connected with localization of fossil energy sources would be largely alleviated. 4 Any scheme of articial photosynthesis includes water oxidation as a crucial step. 6 As a consequence, in the past few years much work has been devoted to identify new good catalysts for water oxidation and integrate them into photo- synthetic schemes. Among molecular catalysts, whereas probably the most ecient water oxidation molecular catalysts are ruthenium compounds, 7-10 catalysts based on earth- abundant metals are particularly attractive. Water oxidation catalysts containing only earth-abundant metals such as cobalt, 11 manganese, 12 iron, 13 copper, 14 and molybdenum 15 have been studied. Surprisingly, in spite of the rich redox chemistry displayed by vanadium compounds, 16 no vanadium species has been reported to behave as a molecular water oxidation catalyst yet. Here we report on the photoinduced water oxidation obtained by using a sacricial system made of Ru(bpy) 3 2+ (bpy = 2,2-bipyridine) as a photosensitizer, Na 2 S 2 O 8 as the sacricial acceptor, and a methoxo-polyoxovanadium cluster, namely (N-Bu 4 )[V 6 O 7 (OCH 3 ) 12 ](1; Bu = n-C 4 H 9 ), 17 as the water oxidation catalyst. It is the rst time, to the best of our knowledge, that a vanadium species is demonstrated to play the role of a water oxidation catalyst, and this result introduces the large and tunable class of polyoxovanadate species into the eld, paving the way for further exploration. Moreover, whereas in most of the formerly studied polyoxometalated water oxidation catalysts the polyoxometalated unit(s) were mainly used as stabilizing units, with the catalytically active metals not belonging to the polyoxometalated scaold, 9,11d,h in the present case the catalytically active center is the polyoxometalated framework. Compound 1 (see Figure 1) has been previously reported by Daniel and Hartl; 17 it is a cluster formally derived from the highly symmetrical Lindqvist structure [M 9 O 19 ] n- , 18 where the 12 μ-bridged oxo ligands are substituted by methoxo ligands. Alkoxo-polyoxovanadium clusters similar to 1 exhibit a quite rich redox activity, with a series of thermodynamically stable redox isomers of general formula [V IV n V V 6-n O 7 (OR) 12 ] (4-n) (R = alkyl groups), of which several species have been synthesized and characterized. 17 In particular, compound 1 exhibits six one- electron redox processes in acetonitrile (although not all of them are reversible), in the potential window -1.0 ÷ +2.2 V vs ferrocene/ferrocinium couple. 17b The whole range of electro- chemical transformation is included, from full reduction to the isovalent vanadium(IV) cluster [V IV 6 O 7 (OCH 3 ) 12 ] 2- to com- plete oxidation to the isovalent vanadium(V) cluster [V V 6 O 7 (OCH 3 ) 12 ] 4+ . 17b The absorption spectrum of each redox isomer has also been identied, 17b evidencing the presence of intervalence bands, which allowed classication of the mixed-valence isomers as class II species, according to the Robin and Day formalism. 19 The redox isomer we prepared, Received: April 22, 2014 Communication pubs.acs.org/JACS © XXXX American Chemical Society A dx.doi.org/10.1021/ja5040182 | J. Am. Chem. Soc. XXXX, XXX, XXX-XXX