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4.5 IR Data Table

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Learning Objectives
  • Understand where certain group frequencies are
  • Be able to read and understand the data table for IR spectroscopy

As stated in the previous section, similar bonds will show up grouped near the same frequency because they tell us about the presence or absence of specific functional groups in a sample. From there, a data table of approximate frequencies for different types of bonds has been created to use to help IR spectrum analysis. 

Table of Common IR Absorptions. 

Approximate Frequency (cm-1) Description Bond Vibration Notes
3500 - 3200 broad, round O-H much broader, lower frequency (3200-2500)
if next to C=O
3400-3300 weak, triangular N-H stronger if next to C=O
3300 medium-strong =C-H (sp C-H)  
3100-3000 weak-medium =C-H (sp2 C-H) can get bigger if lots of bonds present
3000-2900 weak-medium -C-H (sp3 C-H) can get bigger if lots of bonds present
2800 and 2700 medium C-H in O=C-H two peaks; "alligator jaws"
2250 medium C≡N  
2250-2100 weak-medium C≡C stronger if near electronegative atoms
1800-1600 strong C=O lower frequency (1650-1550)
if attached to O or N
middle frequency if attached to C, H
higher frequency (1800) if attached to Cl
1650-1450 weak-medium C=C lower frequency (1600-1450) if conjugated
(i.e. C=C-C=C)
often several if benzene present
1450 weak-medium H-C-H bend  
1300 - 1000 medium-strong C-O higher frequency (1200-1300) if conjugated
(i.e. O=C-O or C=C-O)
1250-1000 medium C-N  
1000-650 strong C=C-H bend often several if benzene present

Note: strong, medium, weak refers to the length of the peak (in the y axis direction).

Note: spectra taken by ATR method (used at CSB/SJU) have weaker peaks between 4000-2500 cm-1 compared to reference spectra taken by transmittance methods (typical on SDBS and other sites).

Exercise 1

What wavenumber range would you predict the triple bond region to be?  

Answer

2200 - 2500 cm-1

Exercise 2

How could you determine the presence of an aldehyde and rule out a ketone? 

Answer

The aldehyde would have peaks at 2700 and 2800 cm-1, whereas the ketone would lack these. The absorption is due to the the Csp2-H bond.

Exercise 3

How can you tell the difference between and alcohol and a carboxylic acid?

Answer

Here the main point of difference is either the presence of a carbonyl (C=O) or its absence. The carboxylic acid contains a C=O, so you would expect a peak somewhere between 1800-1600 cm-1, whereas an alcohol would not have a peak here. 


4.5 IR Data Table is shared under a not declared license and was authored, remixed, and/or curated by Lauren Reutenauer.

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