Theoretical determination of molecular structure. Conformation of some benzo[10]-annulenes and [10]-annulene |
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| Authors: | Jose Ma Hernando-Huelmo Ma Jesús Rioseras-García |
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| Institution: | (1) Departamento de Quimica Fisica, Universidad de Valladolid, E-47005 Valladolid, España |
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| Abstract: | Summary The AM1 method was used to carry out a theoretical study of optimized geometries and energies of some benzoannulenes. The transition state of the transformation of the benzo10]annulene was also determined. The transition state has been located. |
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| Keywords: | Benzoannulenes Conformation AM1 Transition states |
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