Maple-Assisted Template for Automatic Calculation of Second Order AA'XX' NMR Spectra

Gavin Heverly-Coulson , Benjamin Vail , Starr Dostie , Amber Findleton and Mihai Scarlete
Department of Chemistry, Bishop’s University, Lennoxville, Sherbrooke, Quebec J1M 0C8, Canada
J. Chem. Educ., 2008, 85 (12), p 1707
DOI: 10.1021/ed085p1707.2
Publication Date (Web): December 1, 2008

Abstract

This paper presents the creation of a template for the interpretation and simulation of second order AA′XX′ NMR-spectra, starting from the core information offered in a regular undergraduate physical chemistry course.

Keywords (Audience):

Upper-Division Undergraduate

Keywords (Domain):

Laboratory Instruction

Keywords (Feature):

JCE SymMath: Symbolic Mathematics in Chemistry

Keywords (Pedagogy):

Computer-Based Learning

Keywords (Subject):

Chemometrics

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History

  • Received: August 03, 2009

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