Set up the secular determinants for cyclobutadiene, benzene, and cyclooctatetraene and diagonalize them by using mathematical software.
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Set up the secular determinants for cyclobutadiene, benzene, and cyclooctatetraene and diagonalize them by using mathematical software. Use your results to show that the π molecular orbitals of monocyclic polyenes with an even number of carbon atoms follow a pattern in which:
• The π molecular orbitals of lowest and highest energy are non-degenerate.
• The remaining π molecular orbitals exist as degenerate pairs.
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Proof The molecular orbitals of cyclobutadiene C 6 H 6 benzene C 6 H 6 and cyclooctatetraene C 12 H ...View the full answer
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Related Book For
Physical Chemistry Thermodynamics And Kinetics
ISBN: 9781464124518
10th Edition
Authors: Peter Atkins, Julio De Paula
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