Dimitrova, Y. (2004) Ab Initio and DFT Studies of the Vibrational Spectra of Hydrogen-Bonded PhOH…(H2O)4 Complexes. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 60, 3049-3057.
https://doi.org/10.1016/j.saa.2004.01.026

has been cited by the following article:

• TITLE: Determination of Integrated Molar Absorption Coefficients for Gaseous Phenol Infrared Bands and Influence of Water Vapor on Their Values

  AUTHORS: Thomas Onfroy, Olivier Marie

  KEYWORDS: Phenol Gas, Integrated Molar Absorption Coefficients Determination, IR Spectroscopy, Phenol-Water Interaction, Phenol Gas Quantification

  JOURNAL NAME: American Journal of Analytical Chemistry, Vol.10 No.1, January 22, 2019

  ABSTRACT: The integrated molar absorption coefficients for ν(OH) (3655 cm-1), δ(OH) (Q branch at 1176 cm-1 or whole bands), [ν(CCring) + δ(OH)] (Q branch at 1344 cm-1 or whole bands) and γ(CH) (752 cm-1) were determined at 342 K, by recording infrared spectra of pure gaseous phenol at different partial pressure (from 0 to 33 Pa). The integrated molar absorption coefficients (ε) values were obtained with a good reproducibility and the relative uncertainty on the given values is below 2%. The influence of water on the integrated molar absorption coefficients of phenol has been investigated in a large range of nwater/nphenol values (from 0.5 to 6.1 and from 44 to 94) using distinct setups. The infrared spectra of a gas mixture containing a constant amount of phenol and different amount of water were recorded (closed cell) whereas in dynamic condition (under flow) the water partial pressure was kept constant at 1.3 kPa and the phenol partial pressure was increased from 0 to 30 Pa. It is here demonstrated that, at 342 or 355 K, the presence of water does not affect the epsilon values of δ(OH) and [ν(CCring) + δ(OH)] bands.