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相关概念视频

¹³C NMR: ¹H–¹³C Decoupling01:04

¹³C NMR: ¹H–¹³C Decoupling

The probability of having two carbon-13 atoms next to each other is negligible because of the low natural abundance of carbon-13. Consequently, peak splitting due to carbon-carbon spin-spin coupling is not observed in spectra. However, protons up to three sigma bonds away split the carbon signal according to the n+1 rule, resulting in complicated spectra.
A broadband decoupling technique is used to simplify these complex, sometimes overlapping, signals. Broadband decoupling relies on a...
NMR Spectroscopy: Spin–Spin Coupling01:08

NMR Spectroscopy: Spin–Spin Coupling

The spin state of an NMR-active nucleus can have a slight effect on its immediate electronic environment. This effect propagates through the intervening bonds and affects the electronic environments of NMR-active nuclei up to three bonds away; occasionally, even farther. This phenomenon is called spin–spin coupling or J-coupling. Coupling interactions are mutual and result in small changes in the absorption frequencies of both nuclei involved. While nuclei of the same element are involved in...
¹H NMR: Long-Range Coupling01:27

¹H NMR: Long-Range Coupling

The coupling interactions of nuclei across four or more bonds are usually weak, with J values less than 1 Hz. While these are usually not observed in spectra, the presence of multiple bonds along the coupling pathway can result in observable long-range coupling.
In alkenes, spin information is communicated via σ–π overlap, as seen in allylic (four-bond) and homoallylic (five-bond) couplings. These coupling interactions are stronger when the σ bond is parallel to the alkene π orbitals.
Spin–Spin Coupling: Three-Bond Coupling (Vicinal Coupling)01:22

Spin–Spin Coupling: Three-Bond Coupling (Vicinal Coupling)

Vicinal or three-bond coupling is commonly observed between protons attached to adjacent carbons. Here, nuclear spin information is primarily transferred via electron spin interactions between adjacent C‑H bond orbitals. This generally favors the antiparallel arrangement of spins, so 3J values are usually positive.
The extent of coupling depends on the C‑C bond length, the two H‑C‑C angles, any electron-withdrawing substituents, and the dihedral angle between the involved orbitals. The...
Spin–Spin Coupling Constant: Overview01:08

Spin–Spin Coupling Constant: Overview

In bromoethane, the three methyl protons are coupled to the two methylene protons that are three bonds away. In accordance with the n+1 rule, the signal from the methyl protons is split into three peaks with 1:2:1 relative intensities. The methylene protons appear as a quartet, with the relative intensities of 1:3:3:1.
Qualitatively, any spin plus-half nucleus polarizes the spins of its electrons to the minus-half state. Consequently, the paired electron in the hydrogen–carbon bond must have a...
Chemical Shift: Internal References and Solvent Effects01:17

Chemical Shift: Internal References and Solvent Effects

In an NMR sample, precise measurement of the absolute absorption frequencies of nuclei is difficult. A standard internal reference compound is added, and the frequency difference between the reference signal and sample signals is measured.
The internal reference compound generally used in NMR spectroscopy is tetramethylsilane (TMS). TMS is preferred because it is chemically inert, soluble in NMR solvents, and easily removable. Also, the highly shielded methyl protons in TMS yield an intense...

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相关实验视频

Updated: Jun 29, 2026

Atomic Scale Structural Studies of Macromolecular Assemblies by Solid-state Nuclear Magnetic Resonance Spectroscopy
14:55

Atomic Scale Structural Studies of Macromolecular Assemblies by Solid-state Nuclear Magnetic Resonance Spectroscopy

Published on: September 17, 2017

微溶解和13C-Li的NMR合

Rudolf Knorr1, Thomas Menke, Kathrin Ferchland

  • 1Department of Chemistry and Biochemistry, Ludwig-Maximilians-Universität, Butenandtstrasse 5-13, 81377 München, Germany. rhk@cup.uni-muenchen.de

Journal of the American Chemical Society
|October 3, 2008
PubMed
概括

一个新的经验表达式将碳化合物中的NMR合常数 ((1) J(CLi)) 与核和协调供体连接体的数量联系起来. 这一发现可能有助于确定有机聚合物的未知微溶解数.

科学领域:

  • 有机金属化学 有机金属化学
  • 核磁共振光谱学 核磁共振光谱学

背景情况:

  • 核磁共振 (NMR) 光谱对于表征有机化合物至关重要.
  • 了解核周围的协调环境对于预测反应性和结构至关重要.

研究的目的:

  • 提出和验证一种与结构参数相关的NMR合常数的经验表达式.
  • 在各种碳 (C-Li) 化合物中研究溶解和聚合对 (1) J ((CLi) 的影响.

主要方法:

  • 对协调和自由供体配体 (t-BuOMe,Et2O,THF) 的NMR共振的整合.
  • 核Overhauser相关性的分析和固态结构的确定.
  • 对各种C-Li化合物 (单体,二元,四元和聚合物) 应用衍生经验表达式.

主要成果:

  • 建立了一个经验表达式, (1) J(CLi) = L[n(a + d) ](-1),显示了对核数 (n) 和联体协调和 (a + d) 的相互依赖.
  • 微溶解数 (d) 与观察到的NMR化学转移的变化相关,这些变化是对carbanionic (13) C ((alpha),C ((para) 和p-H的变化.
  • 该表达式证明了各种C-Li化合物的适用性,包括溶解和未溶解的聚合物.

结论:

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Using Solution NMR to Characterize Biomolecular Condensates Under Biphasic Conditions
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Using Solution NMR to Characterize Biomolecular Condensates Under Biphasic Conditions

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15N CPMG Relaxation Dispersion for the Investigation of Protein Conformational Dynamics on the &#181;s-ms Timescale
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Last Updated: Jun 29, 2026

Atomic Scale Structural Studies of Macromolecular Assemblies by Solid-state Nuclear Magnetic Resonance Spectroscopy
14:55

Atomic Scale Structural Studies of Macromolecular Assemblies by Solid-state Nuclear Magnetic Resonance Spectroscopy

Published on: September 17, 2017

Using Solution NMR to Characterize Biomolecular Condensates Under Biphasic Conditions
09:01

Using Solution NMR to Characterize Biomolecular Condensates Under Biphasic Conditions

Published on: April 17, 2026

15N CPMG Relaxation Dispersion for the Investigation of Protein Conformational Dynamics on the &#181;s-ms Timescale
08:09

15N CPMG Relaxation Dispersion for the Investigation of Protein Conformational Dynamics on the µs-ms Timescale

Published on: April 19, 2021

  • (1) J(CLi) 合常数可以作为评估有机物种未知的微溶度数的有价值工具.
  • 这项研究强调了分析 (13) C NMR C-Li 多重分离对流动和非流动聚合物的重要性.