Study on the activity of constrained geometry metallocenes

Carlos Alemán, Mark M. Green

Research output: Contribution to journalArticle

Abstract

The activities of a several titanium-based constrained geometry metallocenes (CGM) have been examined with respect to their central-metal net charges. A simple method consisting of a combination of the molecular mechanics and the charge equilibration method was adopted here to determine the structure and the net charge. The results obtained indicate that the net charge on the central-metal of the CGM does dominate the activity. A new CGM, (2,6-dipropylphenylamide) dimethyl (tetramethylcyclopentadienyl) silane titanium dichloride, was synthesized and analyzed.

Original languageEnglish (US)
Pages (from-to)75-78
Number of pages4
JournalMacromolecular Theory and Simulations
Volume10
Issue number2
DOIs
StatePublished - 2001

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Organometallics
Titanium
Geometry
titanium
geometry
Metals
Silanes
Molecular mechanics
dichlorides
silanes
metals

ASJC Scopus subject areas

  • Materials Chemistry
  • Polymers and Plastics

Cite this

Study on the activity of constrained geometry metallocenes. / Alemán, Carlos; Green, Mark M.

In: Macromolecular Theory and Simulations, Vol. 10, No. 2, 2001, p. 75-78.

Research output: Contribution to journalArticle

Alemán, Carlos ; Green, Mark M. / Study on the activity of constrained geometry metallocenes. In: Macromolecular Theory and Simulations. 2001 ; Vol. 10, No. 2. pp. 75-78.
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