首页> 外文期刊>Journal of the American Chemical Society >QUANTITATIVE MULTIPLE-QUANTUM MAGIC-ANGLE-SPINNING NMR SPECTROSCOPY OF QUADRUPOLAR NUCLEI IN SOLIDS
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QUANTITATIVE MULTIPLE-QUANTUM MAGIC-ANGLE-SPINNING NMR SPECTROSCOPY OF QUADRUPOLAR NUCLEI IN SOLIDS

机译:固体中四核的定量多量子磁角自旋核磁共振谱

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摘要

We describe a new approach for observation of multiple-quantum (MQ) NMR spectra of S=3/2 nuclei with magic-angle spinning (MAS). The new method employs the Rotation-induced Adiabatic Coherence Transfer (RIACT) that occurs between triple-quantum (3Q) and central-transition (1Q) coherences in S=3/2 systems. In contrast to currently available coherence-transfer techniques, RIACT is relatively insensitive to the magnitude of the quadrupole interaction for e(2)qQ/h less than or equal to MHz for both 3Q excitation and 3Q-to-1Q conversion. Thus, RIACT provides a means of extracting quantitative information about site populations from isotropic MQ NMR spectra. We illustrate the utility of the approach with Na-23 (S=3/2) MQ quantitative measurements of quadrupolar parameters, chemical shifts, and relative site populations for each of the crystallographically distinct sodium sites.
机译:我们描述了一种新的方法,用于用魔角旋转(MAS)观察S = 3/2核的多量子(MQ)NMR光谱。新方法采用了在S = 3/2系统中发生在三量子(3Q)和中心跃迁(1Q)相干之间的旋转诱导绝热相干转移(RIACT)。与当前可用的相干转移技术相比,对于3Q激励和3Q到1Q转换,对于e(2)qQ / h小于或等于MHz的四极子相互作用,RIACT对四极子相互作用的大小相对不敏感。因此,RIACT提供了一种从各向同性MQ NMR谱图中提取有关位点种群的定量信息的方法。我们用Na-23(S = 3/2)MQ定量测量四极参数,化学位移和每个晶体学上不同的钠位点的相对位点群来说明该方法的实用性。

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