Columns | Column: IR Spectral Interpretation Workshop

In this part of our ongoing review of the infrared spectra of carbonyl-containing functional groups, we will study the spectra of esters and carbonates. Esters are ubiquitous in our food and medicines, and polymeric carbonates form an important part of the materials around us. As always, concepts will be illustrated with reference spectra.

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In the fifth installment of “The Big Review” of infrared (IR) spectral interpretation, we review the spectroscopy of functional groups containing C-O bonds, discuss alcohols and phenols, and see how to use IR spectroscopy to distinguish these alcohols from each other. We then discuss ethers and see how to use IR spectroscopy to distinguish the three different types from each other.

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In the fourth installment of our review of infrared spectral interpretation, we will discuss the spectroscopy of hydrocarbons. We will look at the stretching and bending vibrations of methyl (CH3) and methylene (CH2) groups, how to distinguish them, and how to know whether one or both of these functional groups are present in a sample. We will also discuss aromatic hydrocarbons, specifically the C-H stretching and bending peaks of mono- and disubstituted benzene rings, and how to distinguish them.

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It has occurred to me that, in the 10+ years I have been writing about molecular vibrations, I have never introduced my readers to its basic theory! I will rectify that now. Some of this is new material, and some will be review. Either way, it is important that all this material be covered in one place.

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We wrap up our discussion of the mid-infrared spectra of inorganic compounds by looking at the spectra of silicates, nitrates, and phosphates. We will see that silicates have complex surface chemistry, and that infrared spectroscopy can tell us something about this. We will note that, of the five families of inorganics examined, the wavenumber ranges for the polyatomic anion stretching peaks in several of these functional groups overlap. However, polyatomic anion bending vibration peaks can be used to distinguish the five types of inorganics studied.

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This column discusses the spectra of different inorganic functional groups, such as sulfates, carbonates, nitrates, silicates, and phosphates, with special attention being paid to the stretching and bending vibrations of the polyatomic anions in these compounds.

We continue our survey of the infrared (IR) spectra of polymers with a look at the spectra of polymers that contain carbonyl or C=O bonds. Our long-term goal is to examine the spectra of polymers that contain ketone, carboxylic acid, ester, and carbonate linkages. Studying these spectra is vital, because these molecules are important economically and are ubiquitous in society.

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Determining the components in a mixture can be a significant challenge in infrared spectroscopy, but spectral subtraction can help. We show the proper way to perform spectral subtraction, and the pitfalls to avoid.

One of the biggest practical limitations of infrared spectroscopy is its difficulty in analyzing mixtures. Infrared library searching can help, but it must be done right.