Set up the secular determinants for the homologous series consisting of ethene, butadiene, hexatriene, and octatetraene and
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Set up the secular determinants for the homologous series consisting of ethene, butadiene, hexatriene, and octatetraene and diagonalize them by using mathematical software. Use your results to show that the π molecular orbitals of linear polyenes obey the following rules:
• The π molecular orbital with lowest energy is delocalized over all carbon atoms in the chain.
• The number of nodal planes between C2p orbitals increases with the energy of the π molecular orbital.
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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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