Ontology type: schema:ScholarlyArticle Open Access: True
2002-07
AUTHORSMarko Mäkinen, Pirjo Vainiotalo, Kari Rissanen
ABSTRACTElectrospray ionization Fourier transform ion cyclotron resonance mass spectrometry (ESI-FTICRMS) with additional ab initio calculations were used to examine the alkali metal cation binding selectivity (i.e., molecular recognition) and host properties of tetraethyl resorcarene (1) and its per-methylated derivative (2). The significance of intramolecular hydrogen bonding for the crown conformation was demonstrated. The presence of intramolecular flip-flop hydrogen bonding in 1 was confirmed both with calculations and in ND3-exchange experiments. All the alkali metal cations formed host-guest complexes by docking inside the cavity of the host. Complexation with the larger cations, especially Cs+, was favored. All the alkali metal cations also formed dimeric resorcarene capsules with 1. The capsules were directly H-bonded species, with no linking solvent molecules. ND3-exchange experiments and molecular modeling revealed the significance of direct intermolecular H-bonding for the crown conformation of 1 and stability of the capsule structure. More... »
PAGES851-861
http://scigraph.springernature.com/pub.10.1016/s1044-0305(02)00382-3
DOIhttp://dx.doi.org/10.1016/s1044-0305(02)00382-3
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PUBMEDhttps://www.ncbi.nlm.nih.gov/pubmed/12148809
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curl -H 'Accept: text/turtle' 'https://scigraph.springernature.com/pub.10.1016/s1044-0305(02)00382-3'
RDF/XML is a standard XML format for linked data.
curl -H 'Accept: application/rdf+xml' 'https://scigraph.springernature.com/pub.10.1016/s1044-0305(02)00382-3'
This table displays all metadata directly associated to this object as RDF triples.
283 TRIPLES
21 PREDICATES
91 URIs
30 LITERALS
18 BLANK NODES