Polyhedron 20 (2001) 1365 – 1369 Synthesis, characterization and magnetic properties of [Mn 30 O 24 (OH) 8 (O 2 CCH 2 C(CH 3 ) 3 ) 32 (H 2 O) 2 (CH 3 NO 2 ) 4 ]: the largest manganese carboxylate cluster Mo ` nica Soler a , Evan Rumberger b , Kirsten Folting a , David N. Hendrickson* b,1 , George Christou* a,2 a Department of Chemistry, Indiana Uniersity, Bloomington, IN 47405 -4001, USA b Department of Chemistry, Uniersity of California at San Diego, La Jolla, CA 92093 -0358, USA Received 17 September 2000; accepted 28 October 2000 Abstract We report the synthesis, structure and magnetic properties of a new member of the family of high nuclearity Mn clusters. The complex [Mn 30 O 24 (OH) 8 (O 2 CCH 2 C(CH 3 ) 3 ) 32 (H 2 O) 2 (CH 3 NO 2 ) 4 ](1), is the highest nuclearity manganese cluster to date. Complex 1 was obtained from the comproportionation reaction between Mn(OAc) 2 ·4H 2 O and KMnO 4 , followed by ligand substitution with Me 3 CCH 2 CO 2 H. It is mixed-valent with a trapped-valence 3Mn II , 26Mn III , Mn IV oxidation state description. Dc magnetic susceptibility studies indicate an S =7 ground state, and ac susceptibility studies show an out-of-phase susceptibility signal below 3 K, indicating complex 1 to display the slow magnetization relaxation diagnostic of a single-molecule magnet. © 2001 Elsevier Science Ltd. All rights reserved. Keywords: Manganese; Crystal structure; High nuclearity cluster; Single-molecule magnets www.elsevier.nl/locate/poly 1. Introduction Over the last decade, a strong interest has developed in our group in 3d metal carboxylate clusters because they represent a large family of high-nuclearity prod- ucts with interesting structural, spectroscopic and mag- netic properties. The majority of our efforts has been concentrated in polynuclear manganese complexes and has led to a large variety of clusters, such as Mn 4 [1–3], Mn 6 [4,5], Mn 7 [6,7], Mn 8 [8–11], Mn 9 [9,12,13], Mn 10 [14–17], Mn 11 [18,19], Mn 12 [20,21], Mn 13 [22], Mn 18 [23 – 26] species. Magnetic studies have shown that they often possess a large number of unpaired electrons. In combination with a sufficiently large magnetic an- isotropy, this has led some of them to display the new magnetic phenomenon of single-molecule magnetism (SMM). The largest manganese clusters studied to date are the Mn 18 complexes [23 – 26], possessing three different types of structure and different kinds of magnetic be- havior. We have now been able to synthesize an even larger Mn cluster, [Mn 30 O 24 (OH) 8 (O 2 CCH 2 C- (CH 3 ) 3 ) 32 (H 2 O) 2 (CH 3 NO 2 ) 4 ](1) from a multistep reac- tion employing Mn(O 2 CCH 3 ) 2 ·4H 2 O and KMnO 4 , fol- lowed by addition of tert -butylacetic acid [27]. This compound has been characterized using IR, EA, mag- netic studies and crystallography. In this paper we describe the crystal structure and magnetic properties of this new compound, showing that it is a new example of a single-molecule magnet. 2. X-ray crystallography [Mn 30 O 24 (OH) 8 (O 2 CCH 2 C(CH 3 ) 3 ) 32 (H 2 O) 2 (CH 3 - NO 2 ) 4 ]·solvent (1) crystallizes in the monoclinic space group C 2/c. The asymmetric unit contains half of a Mn 30 complex located on a twofold axis, which passes through four manganese ions (Mn1, Mn2, Mn6 and Mn7). In addition to the main molecule of interest, the asymmetric unit contains some unidentified solvent. 1 *Corresponding author. E-mail: dhendrickson@ucsd.edu 2 *Corresponding author. E-mail: christou@indiana.edu 0277-5387/01/$ - see front matter © 2001 Elsevier Science Ltd. All rights reserved. PII:S0277-5387(01)00620-9