Regioselective synthesis of [1-B10H9(SH)]2–and [2-B10H9(SH)]2–: potential agents for boron–Neutron capture therapy of brain tumours

Abstract
The substitution reaction of [1-B10H9(N2)] with N,N-dimethylthioformamide and the acid-catalyzed nucleophilic substitution of [B10H10]2– with tetramethylthiourea gave [1-B10H9(SCHNMe2)] and [2-B10H9{SC(NMe2)2}] respectively. The basic hydrolysis of these thioamide complexes yielded the 1- and 2-isomers of [B10H9(SH)]2– respectively. Their stereochemistry was determined by 1H n.m.r. spectroscopy from the S–Me chemical shift values of their S-methyl derivatives.

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