A theoretical study of the isomerization process in tris(2-thienyl)methyl radical
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Add time:09/07/2019 Source:sciencedirect.com
An INDO study has shown that the title compound exists in two diastereomeric propeller-like conformations, a cis form (C3 symmetry), and a trans form (C1 symmetry). The cis form is more stable than the trans form by 0·75 kcal/mole. The two forms undergo ready conformational interconversion by the two-ring flip mechanism, with activation energies of ca. 6 kcal/mole.
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