Cocrystals assembled from iodoperfluorobenzene and flexible NTPO via halogen and π‐hole bonds

Two binary cocrystals of 1,4‐diiodotetrafluorobenzene (1,4‐DITFB, C6F4I2) and 1,3,5‐trifluoro‐2,4,6‐triiodobenzene (1,3,5‐TITFB, C6F3I3) with the flexible 2‐{[(naphthalen‐2‐yl)methyl]sulfanyl}pyridine 1‐oxide (NTPO, C16H13NOS) molecule were successfully prepared and characterized by X‐ray diffractio...

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Veröffentlicht in:	Acta crystallographica. Section C, Crystal structure communications Crystal structure communications, 2023-02, Vol.79 (2), p.36-42
Hauptverfasser:	Wang, Hui, Wu, Wen Xin, Jin, Wei Jun
Format:	Artikel
Sprache:	eng
Schlagworte:	AIM analysis cocrystal crystal structure iodoperfluorobenzene NTPO Quantum chemistry Robustness Structural stability supramolecular chemistry X-ray diffraction π‐hole bond σ‐hole bond
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