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. 2021 Oct 27;143(44):18605–18616. doi: 10.1021/jacs.1c08457

Table 1. Born Radii (σi) of the Charged Species Considered in the Charge Screening Modela.

species i σi (Å)
Host4+ (1) 6.50
Na+ 1.94
F 1.48
Cl 2.02
Br 2.12
I 2.36
Host4+ (1)·F 6.53
Host4+ (1)·Cl 6.56
Host4+ (1).Br 6.57
Host4+ (1)·I 6.60
a

A Born radius for host 1 (Host4+) of 6.5 Å was assumed. The Born radii of the host–guest complexes were calculated following eq 8.