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Updated: May 19, 2026

In situ FTIR Spectroscopy as a Tool for Investigation of Gas/Solid Interaction: Water-Enhanced CO2 Adsorption in UiO-66 Metal-Organic Framework
Published on: February 1, 2020
Discovering the active sites for C3 separation in MIL-100(Fe) by using operando IR spectroscopy
Stefan Wuttke1, Philippe Bazin, Alexandre Vimont
1Laboratoire Catalyse et Spectrochimie, ENSICAEN, Université de Caen, CNRS, 6, Boulevard Maréchal Juin, 14050 Caen, France.
This study reveals that unsaturated Fe(II) sites in MIL-100(Fe) metal-organic frameworks (MOFs) are key to separating propane/propene mixtures. Operando methods identified these active sites for enhanced gas separation.
Area of Science:
- Materials Science
- Chemical Engineering
- Adsorption Science
Background:
- Metal-organic frameworks (MOFs) offer tunable properties for gas separation.
- MIL-100(Fe) is a reducible MOF with potential for selective adsorption.
- Understanding the precise mechanism of MOF-based separations is crucial for process optimization.
Purpose of the Study:
- To investigate the separation mechanism of propane/propene mixtures using MIL-100(Fe).
- To identify the specific active sites responsible for separation within the MOF structure.
- To apply operando methodologies for real-time monitoring of adsorption processes.
Main Methods:
- Utilized a reducible MIL-100(Fe) metal-organic framework.
- Employed an operando methodology for online monitoring of material surfaces during separation.
- Obtained breakthrough curves and performed selective poisoning of active sites.
Main Results:
- Identified unsaturated Fe(II) sites as the primary active sites for propane/propene separation.
- Demonstrated the affinity of Fe(II) sites for unsaturated bonds in propene.
- Quantified the roles of both Fe(II) and Fe(III) sites in the separation process.
Conclusions:
- Unsaturated Fe(II) sites in MIL-100(Fe) are crucial for selective propane/propene separation.
- Operando analysis provides direct evidence of active site involvement in MOF separations.
- MIL-100(Fe) shows promise for industrial applications in hydrocarbon mixture separation.
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