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A Theoretical Study of the Electronic Spectra of Adenine and Guanine

✍ Scribed by Fülscher, Markus P.; Serrano-Andrés, Luis; Roos, Björn O.

Book ID
119958222
Publisher
American Chemical Society
Year
1997
Tongue
English
Weight
192 KB
Volume
119
Category
Article
ISSN
0002-7863

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A theoretical study of the infrared spectra of guanine tautomers
✍ Ian R. Gould; Mark A. Vincent; Ian H. Hillier 📂 Article 📅 1993 🏛 Elsevier Science 🌐 English ⚖ 596 KB

The harmonic frequencies, IR intensities and the potential energy distributions of the vibrational modes of the keto and enol tautomers of guanine are calculated at the Hartree-Fock 6-31G\*\* level. The results are compared with the experimental spectra obtained in an argon low temperature matrix. E