Calculation of the Interatomic Force Constants of Pyrazole |
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| Authors: | R. Bouché A. Vanclef L. Coclers |
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| Affiliation: | 1. UCL. , 73, Av. E. Mounier, 1200, Bruxelles, (Belgium);2. Faculté Polytechnique de Mons , (Belgium) |
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| Abstract: | In the frame of a more complete study on the tautomery of the pyrazolines-5-ones, the authors determined the normal vibration modes of pyrazole. They calculate the interatomic force constants by means of a “simplex” optimisation procedure (1). |
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| Keywords: | vibration force constants pyrazole |
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