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• W2024462302 abstract "Different cluster structures of n-heptanol and n-octanol were analyzed by quantum-chemical methods. The optimized structures and IR spectra for clusters involving from 2 to 8 molecules were calculated. By estimation of the hydrogen bond strength the most profitable clusters in the sense of the number of molecules involving in the formation were established. Calculated IR spectra of both species were compared with experimental spectra registered for liquid phase under room temperature." @default.
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• W2024462302 date "2012-05-01" @default.
• W2024462302 modified "2023-09-27" @default.
• W2024462302 title "The structural peculiarities of liquid n-heptanol and n-octanol" @default.
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• W2024462302 doi "https://doi.org/10.1016/j.molliq.2012.02.016" @default.
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