Infra-red spectroscopy: principles, interpretation

Resources | Subject Notes | Chemistry

Infrared Spectroscopy - A-Level Chemistry

Infrared Spectroscopy

Infrared (IR) spectroscopy is a powerful analytical technique used to identify organic compounds by examining their vibrational modes. It provides information about the functional groups present in a molecule.

Principles of Infrared Spectroscopy

IR spectroscopy is based on the absorption of infrared radiation by molecules. When a molecule is exposed to IR radiation, it absorbs energy at specific frequencies that correspond to the vibrational frequencies of its bonds. These vibrations can be:

  • Stretching vibrations (change in bond length)
  • Bending vibrations (change in bond angle)

The energy absorbed is quantized and corresponds to the energy required to excite a particular vibrational mode. The frequency of vibration is related to the mass of the atoms and the strength of the bond.

Suggested diagram: A molecule absorbing IR radiation, with different vibrational modes shown as peaks in the IR spectrum.

When IR radiation passes through a sample, certain frequencies are absorbed, and others are transmitted. The resulting spectrum plots the transmittance (or absorbance) of IR radiation as a function of frequency (or wavenumber). The resulting spectrum is a fingerprint of the molecule.

The IR Spectrometer

A typical IR spectrometer consists of the following components:

  1. Infrared Source: Provides a range of infrared radiation.
  2. Interferometer: Separates the IR beam into two beams: a reference beam and a sample beam.
  3. Sample Cell: Holds the sample in a transparent container (e.g., KBr pellet, thin film).
  4. Diffraction Grating: Separates the IR beam into its component frequencies.
  5. Detector: Measures the intensity of the transmitted IR radiation.
  6. Data Processing Unit: Generates the IR spectrum.

Interpretation of IR Spectra

The IR spectrum is typically displayed as a plot of transmittance (or absorbance) versus wavenumber ($v$ or $\nu$, usually in cm-1). Each functional group in a molecule absorbs IR radiation at characteristic frequencies. These frequencies correspond to specific vibrational modes of the bonds within the functional group.

The following table summarizes the characteristic IR absorption frequencies for some common functional groups:

Functional Group Approximate Wavenumber (cm-1)
O-H 3200-3600 (broad)
-NH3 3300-3500
-NH2 3300-3500
C=O 1650-1800 (strong)
C=C 1600-1680 (strong)
C-H 2850-3000
C-O 1000-1300
C-Cl 600-800

Important Considerations:

  • Peak Intensity: Strong peaks indicate a large change in dipole moment during the vibration.
  • Peak Shape: Broad peaks often indicate hydrogen bonding.
  • Fingerprint Region: The region between 1500-400 cm-1 is complex and unique to each molecule, acting as a fingerprint.

By analyzing the positions and intensities of the absorption bands in an IR spectrum, chemists can identify the functional groups present in a molecule and, therefore, determine its structure.

Applications of IR Spectroscopy

IR spectroscopy is widely used in various fields, including:

  • Organic Chemistry: Identifying functional groups in organic compounds.
  • Polymer Chemistry: Characterizing the structure of polymers.
  • Pharmaceutical Chemistry: Analyzing the composition of drugs.
  • Materials Science: Identifying the composition of materials.
  • Environmental Monitoring: Detecting pollutants.