简单的基于web的交互式可视化来说明和探索核磁共振光谱中的概念

IF 2.9 3区 教育学 Q2 CHEMISTRY, MULTIDISCIPLINARY
Euan D. Doidge*, 
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引用次数: 0

摘要

核磁共振光谱的解释是化学家的一项基本技能。多种策略和资源支持核磁共振波谱学的教学和学习,如工作示例和题库。核磁共振光谱解释的一个挑战是认知超载,特别是对于初学者来说,他们必须吸收新的信息和现有的分子结构知识。一个有用的策略是提供光谱的可视化。然而,现有的软件解决方案(通常需要购买或安装)可能会很复杂,对于初学者来说功能过多,并且专注于有机分子和1H/13C NMR光谱。这项工作提供了免费访问,基于网络的交互式可视化,以支持核磁共振波谱学的教学(https://chem-ed.github.io/NMR/)。这些游戏的设计很简单,专注于定义的概念,尽量减少干扰,并增加互动性以提高用户粘性。这些涵盖了基本的主题,如化学位移、多重性和J耦合常数,对NMR光谱解释相对较新的学习者有用,以及更复杂的领域,如解耦和连续耦合。一个显著的特点是能够考虑与四极核(I > 1/2)和具有100%天然丰度的同位素的耦合,形成卫星信号──这些概念经常被忽视,但对无机化学和多核核磁共振波谱学至关重要,为更高级的学习者提供资源。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Simple Web-Based Interactive Visualizations to Illustrate and Explore Concepts in NMR Spectroscopy

The interpretation of NMR spectra is a fundamental skill for chemists. Multiple strategies and resources support the teaching and learning of NMR spectroscopy, such as worked examples and question banks. A challenge in NMR spectral interpretation is cognitive overload, especially for beginners who must assimilate new information alongside existing knowledge of molecular structure. A useful strategy is to provide visualizations of spectra. However, existing software solutions (often requiring purchase or installation) can be convoluted, with excess features for a beginner and a focus on organic molecules and 1H/13C NMR spectra. This work provides freely accessible, web-based interactive visualizations to support the teaching and learning of NMR spectroscopy (https://chem-ed.github.io/NMR/). These are designed to be simple, focus on defined concepts with minimal distractions, and increase interactivity to enhance engagement. These cover fundamental topics such as chemical shift, multiplicity, and J coupling constants, of use to learners relatively new to NMR spectral interpretation, as well as more complex areas like decoupling and successive coupling. A notable feature is the ability to consider coupling to quadrupolar nuclei (I > 1/2) and isotopes with <100% natural abundance forming satellite signals─concepts often overlooked but essential to inorganic chemistry and multinuclear NMR spectroscopy, providing resources for more advanced learners.

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来源期刊
Journal of Chemical Education
Journal of Chemical Education 化学-化学综合
CiteScore
5.60
自引率
50.00%
发文量
465
审稿时长
6.5 months
期刊介绍: The Journal of Chemical Education is the official journal of the Division of Chemical Education of the American Chemical Society, co-published with the American Chemical Society Publications Division. Launched in 1924, the Journal of Chemical Education is the world’s premier chemical education journal. The Journal publishes peer-reviewed articles and related information as a resource to those in the field of chemical education and to those institutions that serve them. JCE typically addresses chemical content, activities, laboratory experiments, instructional methods, and pedagogies. The Journal serves as a means of communication among people across the world who are interested in the teaching and learning of chemistry. This includes instructors of chemistry from middle school through graduate school, professional staff who support these teaching activities, as well as some scientists in commerce, industry, and government.
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