Terminology for Coordination Polymers and MOFs

  • ChemPubSoc Europe Logo
  • DOI: 10.1002/chemv.201300008
  • Author: Lars Öhrström, IUPAC
  • Published Date: 31 January 2013
  • Copyright: Wiley-VCH Verlag GmbH & Co. KGaA
thumbnail image: Terminology for Coordination Polymers and MOFs

Porous materials are used in many areas of applied science and engineering and we also encounter them in everyday life, for example, zeolites in washing powder. Most often these materials are man-made or naturally occurring zeolites, but lately
 Metal-Organic Frameworks (MOF) and Porous Coordination Polymers (CPs) have emerged as contenders on the porous materials scene. These may have properties radically different from those of zeolites, thus providing other areas of applications or enhanced performance in certain cases. They comprise metal ions or polynuclear metal entities, bridged by organic molecules.

As is often the case, practice precedes theory and synthesis precedes nomenclature and terminology. This has certainly also been the case for this area, an interdisciplinary research field with origins in coordination and solid-state chemistry, that is now also attracting the interest of the chemical industry.


The diversity in both focus and scientific basis of the researchers involved has lead to numerous terminology suggestions and practices for this class of compounds and the International Union of Pure and Applied Chemistry (IUPAC) has, therefore, charged a task group consisting of prominent researchers in the field with the delicate task of defining a suitable terminology that can gain a broad acceptance.



Recommended Hirarchical Terminology
The group recommends a hierarchical terminology where the most general term is coordination polymer. Coordination networks are then a subset of CPs and MOFs a further subset of coordination networks.


One of the criteria a MOF needs to fulfill is that it contains potential voids, but no physical measurements of porosity or other properties are demanded per se.

The use of topology and topology descriptors to enhance the description of crystal structures of MOFs and 3D-coordination polymers is, furthermore, strongly recommended.



An example of the terminology would be:

Example of a Coordination Network that can be seen both, as a 2D-coordination polymer and as a MOF (S. Kitagawa, M. Munakata, T. Tanimura, Inorg. Chem. 1993, 31, 1714.)
Coordinated acetonitrile, acetone solvent, anions and hydrogen atoms not shown.



A separate IUPAC task group chaired by Richard G. Jones, University of Kent, UK, is working on recommendations for naming these compounds.



IUPAC task group assembled in Stockholm
The task group assembled in Stockholm, May 2012.

From left to right: Xiao-Ming Chen, Sun Yat-Sen University, China; Neil Champness, University of Nottingham, UK; Javier García-Martínez, University of Alicante, Spain; Lars Öhrström, Chalmers University of Technology, Sweden; Svante Arrhenius (non member), University of Stockholm, Sweden; Stuart Batten, Monash University, Australia; Susumu Kitagawa, Kyoto University, Japan; Michael O'Keeffe, Arizona State University, USA; Jan Reedijk, Leiden University, the Netherlands; and top right corner Myunghyun Paik Suh, Seoul National University, South Korea.




Public Review
The group’s recommendations have recently been delivered to IUPAC as a set of terms, definitions, and recommendations provided for use in the classification of CPs, networks, and MOFs. These provisional recommendations are currently under public review and can be downloaded at:

http://www.iupac.org/home/publications/provisional-recommendations/currently-under-public-review/currently-under-public-review-container/terminology-of-metal-organic-frameworks-and-coordination-polymers.html

or:

http://www.iupac.org/fileadmin/user_upload/publications/recommendations/ohrstrom_prs.pdf


Comments should be addressed to the task group chair, Professor Lars Öhrström, by 30 April 2013.


Also of interest:

IUPAC to Update Terminology and Nomenclature Rules,
Lars Öhrström,
ChemViews magazine 2012.

Coordination polymers and metal organic frameworks: terminology and nomenclature guidelines

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1 Comments

Lars Öhrström wrote:

Final recommendations are now online

The IUPAC 2013 recommendations on metal-organic frameworks and coordination polymers are now final and online:

http://pac.iupac.org/publications/pac/pdf/2013/pdf/8508x1715.pdf

Mon Aug 12 19:16:22 UTC 2013

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