Competing hydrogen-bond donors: phenols vs. cyanooximes

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dc.contributor.author Aakeröy, Christer B.
dc.contributor.author Epa, Kanishka N.
dc.contributor.author Forbes, Safiyyah
dc.contributor.author Desper, John
dc.date.accessioned 2013-09-10T19:46:34Z
dc.date.available 2013-09-10T19:46:34Z
dc.date.issued 2013-06-24
dc.identifier.uri http://hdl.handle.net/2097/16417
dc.description.abstract Based on a systematic structural study of co-crystals of a ditopic probe molecule, (Z)-N,4-dihydroxybenzimidoyl cyanide, decorated with an –OH group and a cyanooxime moiety, it has been shown that in a competitive molecular recognition event, the former is the better hydrogen-bond donor. This structural behaviour is reflected by calculated electrostatic potential surfaces of the competing donors, which highlights that electrostatic charge can offer a reliable tool for predicting primary hydrogen-bond preferences. en_US
dc.language.iso en_US en_US
dc.relation.uri http://doi.org/10.1039/c3ce41023d en_US
dc.rights This Item is protected by copyright and/or related rights. You are free to use this Item in any way that is permitted by the copyright and related rights legislation that applies to your use. For other uses you need to obtain permission from the rights-holder(s). en_US
dc.rights.uri https://rightsstatements.org/page/InC/1.0/?language=en
dc.subject Hydrogen-bond donors en_US
dc.subject Phenols en_US
dc.subject Cyanooximes en_US
dc.title Competing hydrogen-bond donors: phenols vs. cyanooximes en_US
dc.type Article (author version) en_US
dc.date.published 2013 en_US
dc.citation.doi 10.1039/c3ce41023d en_US
dc.citation.epage 5949 en_US
dc.citation.issue 30 en_US
dc.citation.jtitle CrystEngComm en_US
dc.citation.spage 5946 en_US
dc.citation.volume 15 en_US
dc.contributor.authoreid aakeroy en_US
dc.contributor.authoreid desperj en_US


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This Item is protected by copyright and/or related rights. You are free to use this Item in any way that is permitted by the copyright and related rights legislation that applies to your use. For other uses you need to obtain permission from the rights-holder(s). Except where otherwise noted, the use of this item is bound by the following: This Item is protected by copyright and/or related rights. You are free to use this Item in any way that is permitted by the copyright and related rights legislation that applies to your use. For other uses you need to obtain permission from the rights-holder(s).

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