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. 2015 Mar 10;6(5):2989–2996. doi: 10.1039/c5sc00211g

Table 2. Natural charges and Wiberg Bond Indices of cations [8]+–[10]+ determined by NBO analysis.

[8]+ (M = Au) [9]+ (M = Ag) [10]+ (M = Cu)
Natural charge
M 0.50 0.67 0.69
Mn –0.56 –0.60 –0.71
B 0.66 0.74 0.73
Wiberg bond indices (WBI)
M–Mn 0.14 0.10 0.10
M–B 0.42 0.25 0.25
Mn–B 0.77 0.88 0.85