Understanding the structural properties of p -xylylenebis(triphenylphosphonium) cation under different pH and anion conditions

The organisation of the p -xylylenebis(triphenylphosphonium) dication in the solid state, in crystals formed under a variety of conditions, at different pH values and in the presence of THF and other potential building moieties including p -sulfonatocalix[4]arene, 1-methyl-3-butylimidazolium and aqu...

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Published in:CrystEngComm 2020-11, Vol.22 (44), p.7704-7715
Main Authors: Ling, Irene, Sobolev, Alexandre N., Skelton, Brian W., Raston, Colin L.
Format: Article
Language:English
Subjects:
Atomic properties
Crystallography
Crystals
Gadolinium
Self-assembly
Single crystals
Surface analysis (chemical)
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description The organisation of the p -xylylenebis(triphenylphosphonium) dication in the solid state, in crystals formed under a variety of conditions, at different pH values and in the presence of THF and other potential building moieties including p -sulfonatocalix[4]arene, 1-methyl-3-butylimidazolium and aquated gadolinium( iii ) has been investigated using single crystal X-ray diffraction studies. Striking changes in the dication conformations ( cis - and trans -) that contribute to the different crystal packings of the dication (two-dimensional layerings and three-dimensional scaffoldings) have been established for five different compounds. The interplay and the self-assembled arrays of the dication with other incorporated components and the overall non-covalent interactions have been quantified using Hirshfeld surface analyses.
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source Royal Society of Chemistry:Jisc Collections:Royal Society of Chemistry Read and Publish 2022-2024 (reading list)
subjects Atomic properties
Crystallography
Crystals
Gadolinium
Self-assembly
Single crystals
Surface analysis (chemical)
title Understanding the structural properties of p -xylylenebis(triphenylphosphonium) cation under different pH and anion conditions
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