INFRARED SPECTRA AND GEOMETRY OF TIF2 AND TIF3 IN RARE-GAS MATRICES

被引:56
作者
HASTIE, JW
HAUGE, RH
MARGRAVE, JL
机构
[1] Department of Chemistry, Rice University, Houston
关键词
D O I
10.1063/1.1672391
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
From an infrared study of gaseous TiF2 and TiF3 species isolated in neon and argon rare-gas matrices values of the symmetric and antisymmetric vibrational frequencies were obtained. Bond-angle measurements for TiF2, made using the isotope shift method, indicated a value of 130°±5°. This result has been rationalized in terms of possible electronic configurations for TiF2. Equilibrium constants for the reaction 2TiF3(g)+Ti(s)→3TiF2(g) were measured and combined with calculated free-energy-function data to indicate the stability of TiF2.
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页码:2648 / &
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