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- W2016384435 abstract "Host⋅guest complexes between cucurbit[7] (CB[7]) or CB[8] and diamantane diammonium ion guests 3 or 6 were studied by (1) H NMR spectroscopy and X-ray crystallography. (1) H NMR competition experiments revealed that CB[7]⋅6 is among the tightest monovalent non-covalent complexes ever reported in water with Ka =7.2×10(17) M(-1) in pure D2 O and 1.9×10(15) M(-1) in D2 O buffered with NaO2 CCD3 (50 mM). The crystal structure of CB[7]⋅6 allowed us to identify some of the structural features responsible for the ultratight binding, including the distance between the NMe3 (+) groups of 6 (7.78 Å), which allows it to establish 14 optimal ion-dipole interactions with CB[7], the complementarity of the convex van der Waals surface contours of 6 with the corresponding concave surfaces of CB[7], desolvation of the CO portals within the CB[7]⋅6 complex, and the co-linearity of the C7 axis of CB[7] with the N(+) ⋅⋅⋅N(+) line in 6. This work further blurs the lines of distinction between natural and synthetic receptors." @default.
- W2016384435 created "2016-06-24" @default.
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- W2016384435 date "2014-01-02" @default.
- W2016384435 modified "2023-10-10" @default.
- W2016384435 title "Cucurbit[7]uril⋅Guest Pair with an Attomolar Dissociation Constant" @default.
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- W2016384435 doi "https://doi.org/10.1002/anie.201309635" @default.
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