A spectroscopic and theoretical study in the near-infrared region of low concentration aliphatic alcohols Article Swipe
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Krzysztof B. Beć
,
Yoshisuke Futami
,
Marek J. Wójcik
,
Yukihiro Ozaki
·
YOU?
·
· 2016
· Open Access
·
· DOI: https://doi.org/10.1039/c6cp00924g
· OA: W2313396085
YOU?
·
· 2016
· Open Access
·
· DOI: https://doi.org/10.1039/c6cp00924g
· OA: W2313396085
The near-infrared (NIR) spectra of low-concentration (5 × 10<sup>−3</sup> M) solutions in CCl<sub>4</sub> of basic aliphatic alcohols, methanol, ethanol, and 1-propanol were, for the first time, calculated by second-order vibrational perturbation theory computations and were compared with the corresponding experimental data.
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