2007 Full Paper Macromolecular Chemistry and Physics wileyonlinelibrary.com DOI: 10.1002/macp.201300764 Stereospecific Styrene Polymerization by Methylalumoxane-Activated Ti (IV) N- Trimethylsilylamido Complexes Bearing the N-Biphenyl or N-(6-(2-(Diethylboryl)phenyl)- Pyrid-2-yl) Motif Gurram Venkata Narayana, Guangjuan Xu, Dongren Wang, Maria Speiser, Wolfgang Frey, Michael R. Buchmeiser* Cp’TiCl 2 ( N-(6-(2-(diethylboryl)phenyl)pyrid-2-yl)SiMe 3 ), [Cp’ = C 5 H 5 ( 3), C 5 (CH 3 ) 5 ( 4)], and the aminoborane-free half-titanocene analogs with the general formula: Cp’TiCl 2 (N-(biphenyl- 3-yl)SiMe 3 ); [Cp’ = C 5 H 5 ( 7), C 5 (CH 3 ) 5 ( 8)] are synthesized and used in the polymerization of styrene. All the pre-catalysts are active in styrene poly- merization, >90% syndiotactic poly(styrene) ( st-PS) is pro- duced, exceeding that of their ansa-homologues (C 5 (CH 3 ) 5 ) TiCl 2 (6-(2-(diethylboryl)phenyl)pyrid-2-ylamido)(dimethyl- silyl) ( 9) and (C 5 (CH 3 ) 5 )TiCl 2 (3-biphen-3-ylamido)(dimethyl- silyl) ( 10) both in activity and molecular weight. Pre-catalyst 8 allows for the synthesis of high-molecular-weight st-PS with activities up to 5000 kg st-PS mol cat -1 h -1 . Implications of the 2-(diethylboryl)phenyl)pyrid-2-yl group on polymerization activity and molecular weight are discussed. Dr. G. V. Narayana, G. Xu, Dr. D. Wang, M. Speiser, Prof. M. R. Buchmeiser Institut für Polymerchemie, Lehrstuhl für Makromolekulare Stoffe und Faserchemie, Universität Stuttgart, Pfaffenwaldring 55, D-70569 Stuttgart, Germany E-mail: michael.buchmeiser@ipoc.uni-stuttgart.de Dr. W. Frey Institut für Organische Chemie, Universität Stuttgart, Pfaffenwaldring 55, D-70569 Stuttgart, Germany Prof. M. R. Buchmeiser Textilchemie und Chemiefasern (ITCF), Körschtalstr. 26, D-73770 Denkendorf, Germany yield syndiotactic poly(styrene) ( st-PS). Zambelli et al. [2,3] have shown that with tetrabenzyltitanium/MAO styrene insertion proceeds 100% via secondary insertion yielding metal-benzyl species. Since then, significant progress has been made. [4–7] st-PS is a crystalline material with a high melting point (270 °C) and good resistance to water and organic solvents at ambient temperature. Recent studies have identified mono( η 5 -cyclopentadienyl) com- plexes of group IV metals as efficient catalysts for styrene polymerization. While [Zr( η 5 -C 5 H 5 )]-based complexes are poorly syndioselective, the related Ti complexes are effec- tive in the stereocontrol of poly(styrene). [8–10] Here, we present out results on the homopolymeri- zation of styrene by non-bridged half-titanocene com- plexes containing an aminoborane moiety of the formula Cp’TiCl 2 ( N(6-(2-(diethylboryl)phenyl)-pyrid-2-yl)Si(CH 3 ) 3 ), Cp’ = C 5 H 5 ( 3), C 5 (CH 3 ) 5 ( 4) and by the aminoborane-free 1. Introduction The stereospecific polymerization of styrene was first accomplished by Ishihara et al. [1] with Ti-based half-met- allocenes in the presence of methylalumoxane (MAO) to Macromol. Chem. Phys. 2014, 215, 2007−2013 © 2014 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim