Ferrocene and Ruthenocene are dicyclopentadienyl complexes, where the metal (Fe and Ru) is sandwiched between two cyclopentadienyl structures. The paper describes a comparative study of the electronic and geometric structural properties of ferrocene and ruthenocene. The various physical properties (stability, geometry, symmetry etc.) of the two are reviewed to elucidate the differences between ...

in this study we have tested the ability of a standard dft computational protocol to reproduce the experimentally obtained stereoselectivity of 26 different c2-symmetric zirconocene catalysts active in propylene polymerization. the catalysts were chosen for their relevance in metallocene catalyzed polymerization of propylene. to this end, primary insertion of both si- and re-propylene enantiofa...

beside ziegler-natta and phillips catalysts the development of methylaluminoxane (mao) as cocatalyst incombination with metallocenes or other transition metal complexes for the polymerization of olefins haswidely increased the possibilities in controlling the polymer composition, polymer structure, tacticity and special properties with high precision. these catalysts allow the synthesis of isot...

bis(2-r-ind)zrcl2 (r: h or phenyl) was supported on different types of silica by in situ impregnation method and used for ethylene polymerization. in this method, the step of catalyst loading on support was eliminated and common alkyl aluminum (triisobutylaluminum, tiba) cocatalyst was used instead of expensive methyl aluminiumoxane (mao) cocatalyst in the polymerization. the effect of surface ...

Biomedical inorganic chemistry is a relative new research field and investigates possible applications of metal containing agents which display biological activities!,2. An important part of these studies deals with compounds that display antitumor properties. The most successful anticancer drug to date containing a transition metal is cisplatin, [Pt(NH3)2Ch]3. The bioactivity of organometallic...

A range of 1,3-di(metallocenyl)allylium salts [Mc(CH)(3)Mc'](+)[X](-) [Mc, Mc' = ferrocenyl (Fc), 2,3,4,5,1',2',3',4'-octamethylferrocen-1-yl (Fc' '), ruthenocenyl (Rc); X = BF(4), PF(6)] was synthesized by reaction of (2-lithiovinyl)metallocenes with formylmetallocenes, followed by treatment of the resulting alcohols with HX. Two salts with X = BAr'(4) [Ar' = 3,5-(CF(3))(2)C(6)H(3)] were synth...

We treated silica with tris(pentafluorophenyl)borane, B(C6F5)3, to create borane-functionalized support, SiO2–B(C6F5)3 which was then used as a support and co-catalyst for the in situ activated dichloro-zirconocene (Cp2ZrCl2/TIBA) and dimethyl-zirconocene catalyst systems (Cp2Zr(CH3)2) for ethylene polymerization. The surface modifications of SiO2– B(C6F5)3 was investigated by SEM–EDX, FTIR and...

Abstract Derivatives of fused 1,2,4-triazines containing heterocyclic and metallocene fragments were obtained by one-pot oxidative cyclization hydrazones in the presence hypervalent iodine(III) reagents. For 1,2,4-triazolo[4,3-a]azines, ability to activate HSF1 was investigated. The compounds shown increase degree activation. It that can be used induce Hsp70 expression decrease extent mutant HT...