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Preparation and Characterization of the First Binary Titanium Azides, Ti(N3)4, P(C6H5)4Ti(N3)5 and P(C6H5)42Ti(N3)6 and on Linear Ti-N-NN Coordination

Authors: Karl O. Christe; Ralf Haiges; Stefan Schneider; Thorsten Schroer; Jerry A. Boatz; ENGINEERING RESEARCH AND CONSULTING INCHUNTSVILLE AL
 
Abstract: Where as numerous partially azide-substituted titanium compounds had previously been reported, 1-7 no binary titanium azides were known. In a recent theoretical study the group 4 metal tetrazides M(N3)4 (M = Ti, Zr, Hf, Th) were predicted 8 to be vibrationally stable exhibiting tetrahedral structures with unique linear M-N-NN bond angles (see Figure 1). All previously characterized covalent binary azide species possess bent M-N-NN angles. In this paper we wish to report the synthesis, isolation and characterization of the first binary titanium azide species Ti(N3)4, Ti(N3)4, Ti(N3)5- and Ti(N3)62-, and provide explanations for the observed and predicted Ti-N-NN bond angles.

Limitations: APPROVED FOR PUBLIC RELEASE
Pages: 21
Report Date: 12 MAR 2004
Contract Number: F04611-99-C-0025
Report Number: A086224
Keywords relating to this report:
AZIDES
COVALENT BONDS
ELECTRON ACCEPTORS
MOLECULAR ORBITALS
RAMAN SPECTRA
ROCKET PROPELLANTS
SYNTHESIS(CHEMISTRY)
TITANIUM COMPOUNDS
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