(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 ( P 2 1 / c ) symmetry. The molecular structure features an angular (phenyliodosyl)benzene cation, the geometry of whic...

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Veröffentlicht in:IUCrData 2022-05, Vol.7 (5), Article x220522
Hauptverfasser: Smith, Timothy J., Koser, Gerald, Chen, Yi, Zeller, Matthias, Iacino, Rocco, Selzer, Nichole
Format: Artikel
Sprache:eng
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Zusammenfassung: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 ( P 2 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.
ISSN:2414-3146
2414-3146
DOI:10.1107/S2414314622005223