(Phenyl­iodos­yl)benzene tosyl­ate dihydrate

The structure of the title salt (systematic name: oxodiphenyl-λ(5)-iodanylium 4-methyl­benzene­sulfonate dihydrate), C(12)H(10)IO(+)·C(7)H(7)O(3)S(−)·2H(2)O, at 150 K, has monoclinic (P2(1)/c) symmetry. The mol­ecular structure features an angular (phenyl­iodos­yl)benzene cation, the geometry of whi...

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Autores principales: Smith, Timothy J., Koser, Gerald, Chen, Yi, Zeller, Matthias, Iacino, Rocco, Selzer, Nichole
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2022
Materias:
Data Reports
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9462033/
https://www.ncbi.nlm.nih.gov/pubmed/36338938
http://dx.doi.org/10.1107/S2414314622005223
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author Smith, Timothy J.
Koser, Gerald
Chen, Yi
Zeller, Matthias
Iacino, Rocco
Selzer, Nichole
author_facet Smith, Timothy J.
Koser, Gerald
Chen, Yi
Zeller, Matthias
Iacino, Rocco
Selzer, Nichole
author_sort Smith, Timothy J.
collection PubMed
description The structure of the title salt (systematic name: oxodiphenyl-λ(5)-iodanylium 4-methyl­benzene­sulfonate dihydrate), C(12)H(10)IO(+)·C(7)H(7)O(3)S(−)·2H(2)O, at 150 K, has monoclinic (P2(1)/c) symmetry. The mol­ecular structure features an angular (phenyl­iodos­yl)benzene cation, the geometry of which was hitherto undescribed in the literature: in the cation, both I—C bonds are approximately normal to the I=O bond, forming a C—I—C angle of 95.36 (4)°. The crystal structure displays O—H⋯O, O—H⋯I and O—H⋯S hydrogen bonding. [Image: see text]
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spelling pubmed-94620332022-11-04 (Phenyl­iodos­yl)benzene tosyl­ate dihydrate Smith, Timothy J. Koser, Gerald Chen, Yi Zeller, Matthias Iacino, Rocco Selzer, Nichole IUCrdata Data Reports The structure of the title salt (systematic name: oxodiphenyl-λ(5)-iodanylium 4-methyl­benzene­sulfonate dihydrate), C(12)H(10)IO(+)·C(7)H(7)O(3)S(−)·2H(2)O, at 150 K, has monoclinic (P2(1)/c) symmetry. The mol­ecular structure features an angular (phenyl­iodos­yl)benzene cation, the geometry of which was hitherto undescribed in the literature: in the cation, both I—C bonds are approximately normal to the I=O bond, forming a C—I—C angle of 95.36 (4)°. The crystal structure displays O—H⋯O, O—H⋯I and O—H⋯S hydrogen bonding. [Image: see text] International Union of Crystallography 2022-05-20 /pmc/articles/PMC9462033/ /pubmed/36338938 http://dx.doi.org/10.1107/S2414314622005223 Text en © Smith et al. 2022 https://creativecommons.org/licenses/by/4.0/This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Data Reports
Smith, Timothy J.
Koser, Gerald
Chen, Yi
Zeller, Matthias
Iacino, Rocco
Selzer, Nichole
(Phenyl­iodos­yl)benzene tosyl­ate dihydrate
title (Phenyl­iodos­yl)benzene tosyl­ate dihydrate
title_full (Phenyl­iodos­yl)benzene tosyl­ate dihydrate
title_fullStr (Phenyl­iodos­yl)benzene tosyl­ate dihydrate
title_full_unstemmed (Phenyl­iodos­yl)benzene tosyl­ate dihydrate
title_short (Phenyl­iodos­yl)benzene tosyl­ate dihydrate
title_sort (phenyl­iodos­yl)benzene tosyl­ate dihydrate
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9462033/
https://www.ncbi.nlm.nih.gov/pubmed/36338938
http://dx.doi.org/10.1107/S2414314622005223
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AT kosergerald phenyliodosylbenzenetosylatedihydrate
AT chenyi phenyliodosylbenzenetosylatedihydrate
AT zellermatthias phenyliodosylbenzenetosylatedihydrate
AT iacinorocco phenyliodosylbenzenetosylatedihydrate
AT selzernichole phenyliodosylbenzenetosylatedihydrate

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