29Si and 19F MAS NMR spectra of isolated 29Si(19F)2 and 29Si(19F)3 spin systems:: experiments and simulations

被引:14
|
作者
Helluy, X
Pietschnig, R
Sebald, A
机构
[1] Univ Bayreuth, Bayer Geoinst, D-95440 Bayreuth, Germany
[2] Graz Univ, Inst Chem, A-8010 Graz, Austria
关键词
Si-29-F-19 spin systems; Si-29 MAS NMR; F-19 MAS NMR; spectral lineshapes; molecular dynamics;
D O I
10.1016/S0926-2040(03)00028-6
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
We consider Si-29 and F-19 MAS NMR spectra of isolated Si-29(F-19)(2) and Si-29(F-19)(3) spin systems in two organosilicon compounds of the type RR'SiF2 and RSiF3 (R, R' = organic ligands). Experimental spectra are analysed by means of numerical simulations. It is found that the SiF3 group in RSiF3 is reorienting rapidly around the molecular Si-C bond direction in the solid state. The two F-19 shielding tensors in RR'SiF2 have strongly differing orientations relative to the two Si-F bond directions in the molecule. Possibilities and limitations of straightforward MAS NMR approaches for the full characterisation of Si-29(F-19)2 and Si-21(F-19)(3) spin systems and other dipolar coupled two and three-spin systems are discussed. (C) 2003 Elsevier Science (USA). All rights reserved.
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页码:286 / 300
页数:15
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