No. Complex Eeles Erep Eind Edisp Eint(SAPT) ΔE(BSSE)(MP2)
1 F2O2···F -38.58 71.86 -50.17 -8.06 -24.94 -22.23
2 F2O2···Cl -36.27 73.85 -48.62 -10.81 -21.86 -22.78
3 F2O2···Br -37.19 76.26 -51.69 -11.45 -24.06 -26.14
4 F2O2···NC -5.10 7.39 -4.19 -2.78 -4.68 -3.82
5 (CN)2O···NO3 -25.02 21.89 -9.61 -7.69 -20.43 -18.36
6 F2O···F -60.67 100.45 -71.49 -9.87 -41.58 -37.74
7 F2O···Cl -72.21 146.91 -109.29 -17.09 -51.69 -54.1
8 F2O···Br -68.20 138.39 -103.18 -16.86 -49.85 -54.93
9 F2O···NCO -51.21 95.91 -62.44 -13.72 -31.46 -31.84
10 F2O···NCO -10.08 13.32 -5.71 -3.74 -6.21 -6.08
11 F2O···SCN -53.73 104.24 -58.67 -15.21 -53.73 -40.90
12 F2O···NCS -5.58 6.89 -2.45 -3.73 -4.86 -4.89
13 Cl2O···OCN -1.34 7.56 -4.11 -3.78 -1.68 -2.30
14 NCFO···F -69.84 95.26 -71.42 -10.54 -56.54 -50.86
15 NCFO···Cl -61.05 97.84 -73.93 -13.81 -50.95 -48.74
16 NCFO···Br -59.64 98.03 -76.27 -14.26 -52.14 -51.46