Cucurbit[6]uril p-xylylenediammonium diiodide decahydrate inclusion complex

Cucurbit[6]uril p-xylylenediammonium diiodide decahydrate inclusion complex

The title inclusion complex, C36H36N24O12·C8H14N22+·2I−·10H2O, displays a large ellipsoidal deformation of the cucurbit[6]uril (CB[6]) skeleton upon complex formation. The benzene ring of the cation is rotationally disordered between two orientations in a ratio o...

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Main Authors: Wei-Hao Huang, Peter Y. Zavalij, Lyle Isaacs
Format: Article
Language:English
Published: International Union of Crystallography 2008-07-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536808018412
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spelling doaj-4106f69bbb584e07ba47398ac8c597422020-11-25T00:35:55ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682008-07-01647o1321o132210.1107/S1600536808018412Cucurbit[6]uril p-xylylenediammonium diiodide decahydrate inclusion complexWei-Hao HuangPeter Y. ZavalijLyle IsaacsThe title inclusion complex, C36H36N24O12·C8H14N22+·2I−·10H2O, displays a large ellipsoidal deformation of the cucurbit[6]uril (CB[6]) skeleton upon complex formation. The benzene ring of the cation is rotationally disordered between two orientations in a ratio of 3:1. The solvent H2O molecules form a hydrogen-bonded network by interaction with the carbonyl groups of CB[6] and the I− counterions. The crystal studied exhibited non-merohedral twinning. Both CB[6] and the cation are centrosymmetric.http://scripts.iucr.org/cgi-bin/paper?S1600536808018412
collection DOAJ
language English
format Article
sources DOAJ
author Wei-Hao Huang
Peter Y. Zavalij
Lyle Isaacs
spellingShingle Wei-Hao Huang
Peter Y. Zavalij
Lyle Isaacs
Cucurbit[6]uril p-xylylenediammonium diiodide decahydrate inclusion complex
Acta Crystallographica Section E
author_facet Wei-Hao Huang
Peter Y. Zavalij
Lyle Isaacs
author_sort Wei-Hao Huang
title Cucurbit[6]uril p-xylylenediammonium diiodide decahydrate inclusion complex
title_short Cucurbit[6]uril p-xylylenediammonium diiodide decahydrate inclusion complex
title_full Cucurbit[6]uril p-xylylenediammonium diiodide decahydrate inclusion complex
title_fullStr Cucurbit[6]uril p-xylylenediammonium diiodide decahydrate inclusion complex
title_full_unstemmed Cucurbit[6]uril p-xylylenediammonium diiodide decahydrate inclusion complex
title_sort cucurbit[6]uril p-xylylenediammonium diiodide decahydrate inclusion complex
publisher International Union of Crystallography
series Acta Crystallographica Section E
issn 1600-5368
publishDate 2008-07-01
description The title inclusion complex, C36H36N24O12·C8H14N22+·2I−·10H2O, displays a large ellipsoidal deformation of the cucurbit[6]uril (CB[6]) skeleton upon complex formation. The benzene ring of the cation is rotationally disordered between two orientations in a ratio of 3:1. The solvent H2O molecules form a hydrogen-bonded network by interaction with the carbonyl groups of CB[6] and the I− counterions. The crystal studied exhibited non-merohedral twinning. Both CB[6] and the cation are centrosymmetric.
url http://scripts.iucr.org/cgi-bin/paper?S1600536808018412
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AT peteryzavalij cucurbit6urilpxylylenediammoniumdiiodidedecahydrateinclusioncomplex
AT lyleisaacs cucurbit6urilpxylylenediammoniumdiiodidedecahydrateinclusioncomplex
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