Analyzing and Interpreting NMR Spin-Spin Coupling Constants Using Molecular Orbital Calculations.

Autschbach, Jochen; Le Guennic, Boris

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ERIC Number: EJ755046

Record Type: Journal

Publication Date: 2007-Jan

Pages: 16

Abstractor: Author

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ISSN: ISSN-0021-9584

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Analyzing and Interpreting NMR Spin-Spin Coupling Constants Using Molecular Orbital Calculations

Autschbach, Jochen; Le Guennic, Boris

Journal of Chemical Education, v84 n1 p156-171 Jan 2007

Molecular orbital plots are used to analyze and interpret NMR spin-spin coupling constants, also known as J coupling constants. Students have accepted the concept of contributions to molecular properties from individual orbitals without the requirement to provide explicit equations.

Descriptors: Chemistry, Computation, Molecular Structure, Science Education, Science Experiments

Division of Chemical Education of the American Chemical Society. Subscription Department, P.O. Box 1267, Bellmawr, NJ 08099-1267. Tel: 800-691-9846; Tel: 856-931-5825; Fax: 856-931-4115; e-mail: jchemed@egpp.com; Web site: http://jchemed.chem.wisc.edu/

Publication Type: Journal Articles; Reports - Descriptive

Education Level: N/A

Audience: N/A

Language: English

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