The Infrared spectrum of hexafluoroisopropanol in the region of the first and second overtones of the OH stretching vibration in the gas phase and in liquefied xenon
Melikova S.M. 1, Rutkowski K.S. 1, Siavichay M.J.1
1St. Petersburg State University, St. Petersburg, Russia
Email: s.melikova@spbu.ru, k.rutkovsky@spbu.ru, st101368@student.spbu.ru

PDF
The IR spectra of hexafluoroisopropanol were studied in the gas phase at 300 K and in liquefied xenon in the temperature range of 165-190 K. The positions and relative intensities of the bands of the first and second overtone of the ν(OH) stretching vibration were measured. Calculations performed using the Gaussian package confirm experimental observations. Keywords: fluorinated alcohols, hexafluoroisopropanol, infrared spectrum, quantum chemical calculation, anharmonicity, local modes model.
  1. T. Shimuzu, E. Nogami, Y. Ito, K. Morikawa, M. Nagane, T. Yamashita, T. Ogawa, F. Kametani, H. Yagi, N. Hachiya. Neurochemical Research, 46, 2056 (2021)
  2. B. Czarnik-Matusewicz, S. Pilorz, D. Bienko, D. Michalska. Vibr. Spectrosc., 47, 44 (2008). DOI: 10.1016/j.vibspec.2008.01.016
  3. S.M. Melikova, K.S. Rutkowski. Opt. Spectr., 130 (11), 1398 (2022). DOI: 10.21883/EOS.2022.11.55097.4071-22
  4. M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, G. Scalmani, V. Barone, G. A. Petersson, H. Nakatsuji, X. Li, M. Caricato, A.V. Marenich, J. Bloino, B.G. Janesko, et.al., Gaussian 16, Revision A.03, Gaussian, Inc., Wallingford CT, 2016
  5. C. M ller, M.S. Plesset. Adv. Chem. Phys., 57, 1 (1984)
  6. K.S. Rutkowski, S.M. Melikova, D.N. Shchepkin. Vibr. Spectrosc., 24, 277 (2000)
  7. K.S. Schweizer, D. Chandler. J. Chem. Phys., 76, 2296 (1982)
  8. N. Gayathi, S. Bhattcharyya, B. Bagchi. J. Chem. Phys., 107, 10381 (1997)
  9. Yu.S. Efremov, N.I. Zhirnov. Opt. Spectrosc., 49, 1119 (1980) (in Russian)

Подсчитывается количество просмотров абстрактов ("html" на диаграммах) и полных версий статей ("pdf"). Просмотры с одинаковых IP-адресов засчитываются, если происходят с интервалом не менее 2-х часов.

Дата начала обработки статистических данных - 27 января 2016 г.

Publisher:

Ioffe Institute

Institute Officers:

Director: Sergei V. Ivanov

Contact us:

26 Polytekhnicheskaya, Saint Petersburg 194021, Russian Federation
Fax: +7 (812) 297 1017
Phone: +7 (812) 297 2245
E-mail: post@mail.ioffe.ru