Issue 9, 2007
From the journal:

CrystEngComm

Towards proton transfer in hydrogen bonded molecular complexes: joint experimental and theoretical modelling and an energy scale for polymorphism†

Marc Schmidtmann,a   Matthias J. Gutmann,b   Derek S. Middlemissa  and  Chick C. Wilson*a  

* Corresponding authors

a WestCHEM, Department of Chemistry, University of Glasgow, Glasgow, UK
E-mail: c.c.wilson@chem.gla.ac.uk
Fax: +44 141 330 8775
Tel: +44 141 330 8522

b ISIS, Rutherford Appleton Laboratory, Chilton, Didcot, Oxon, UK

Abstract

Exploring possible proton transfer effects in polymorphic molecular complexes of isonicotinamide with oxalic acid highlights the significant covalent nature of short, strong hydrogen bonds in these complexes. An energy scale for the observed polymorphism in these complexes is established.

Graphical abstract: Towards proton transfer in hydrogen bonded molecular complexes: joint experimental and theoretical modelling and an energy scale for polymorphism

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Article information

DOI
https://doi.org/10.1039/B709136M
Article type
Communication
Submitted
13 Apr 2007
Accepted
19 Jun 2007
First published
13 Jul 2007

CrystEngComm, 2007,9, 743-745

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Towards proton transfer in hydrogen bonded molecular complexes: joint experimental and theoretical modelling and an energy scale for polymorphism

M. Schmidtmann, M. J. Gutmann, D. S. Middlemiss and C. C. Wilson, CrystEngComm, 2007, 9, 743 DOI: 10.1039/B709136M

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