01 acetate ... methanol (0.90) |
MP2/cc-pVTZ CP |
-18.76 |
01 acetate ... methanol (0.95) |
MP2/cc-pVTZ CP |
-19.58 |
01 acetate ... methanol (1.00) |
MP2/cc-pVTZ CP |
-19.75 |
01 acetate ... methanol (1.05) |
MP2/cc-pVTZ CP |
-19.49 |
01 acetate ... methanol (1.10) |
MP2/cc-pVTZ CP |
-18.94 |
01 acetate ... methanol (1.25) |
MP2/cc-pVTZ CP |
-16.52 |
01 acetate ... methanol (1.50) |
MP2/cc-pVTZ CP |
-12.35 |
01 acetate ... methanol (2.00) |
MP2/cc-pVTZ CP |
-7.04 |
02 acetate ... water (0.90) |
MP2/cc-pVTZ CP |
-20.28 |
02 acetate ... water (0.95) |
MP2/cc-pVTZ CP |
-21.04 |
02 acetate ... water (1.00) |
MP2/cc-pVTZ CP |
-21.06 |
02 acetate ... water (1.05) |
MP2/cc-pVTZ CP |
-20.62 |
02 acetate ... water (1.10) |
MP2/cc-pVTZ CP |
-19.9 |
02 acetate ... water (1.25) |
MP2/cc-pVTZ CP |
-17.06 |
02 acetate ... water (1.50) |
MP2/cc-pVTZ CP |
-12.6 |
02 acetate ... water (2.00) |
MP2/cc-pVTZ CP |
-7.28 |
03 acetate ... methylamine (0.90) |
MP2/cc-pVTZ CP |
-10.89 |
03 acetate ... methylamine (0.95) |
MP2/cc-pVTZ CP |
-11.39 |
03 acetate ... methylamine (1.00) |
MP2/cc-pVTZ CP |
-11.46 |
03 acetate ... methylamine (1.05) |
MP2/cc-pVTZ CP |
-11.24 |
03 acetate ... methylamine (1.10) |
MP2/cc-pVTZ CP |
-10.85 |
03 acetate ... methylamine (1.25) |
MP2/cc-pVTZ CP |
-9.26 |
03 acetate ... methylamine (1.50) |
MP2/cc-pVTZ CP |
-6.7 |
03 acetate ... methylamine (2.00) |
MP2/cc-pVTZ CP |
-3.66 |
04 methylammonium ... formaldehyde (0.90) |
MP2/cc-pVTZ CP |
-17.93 |
04 methylammonium ... formaldehyde (0.95) |
MP2/cc-pVTZ CP |
-18.85 |
04 methylammonium ... formaldehyde (1.00) |
MP2/cc-pVTZ CP |
-19.1 |
04 methylammonium ... formaldehyde (1.05) |
MP2/cc-pVTZ CP |
-18.9 |
04 methylammonium ... formaldehyde (1.10) |
MP2/cc-pVTZ CP |
-18.41 |
04 methylammonium ... formaldehyde (1.25) |
MP2/cc-pVTZ CP |
-16.15 |
04 methylammonium ... formaldehyde (1.50) |
MP2/cc-pVTZ CP |
-12.27 |
04 methylammonium ... formaldehyde (2.00) |
MP2/cc-pVTZ CP |
-7.44 |
05 methylammonium ... methylamine (0.90) |
MP2/cc-pVTZ CP |
-27.05 |
05 methylammonium ... methylamine (0.95) |
MP2/cc-pVTZ CP |
-28.22 |
05 methylammonium ... methylamine (1.00) |
MP2/cc-pVTZ CP |
-28.56 |
05 methylammonium ... methylamine (1.05) |
MP2/cc-pVTZ CP |
-28.31 |
05 methylammonium ... methylamine (1.10) |
MP2/cc-pVTZ CP |
-27.66 |
05 methylammonium ... methylamine (1.25) |
MP2/cc-pVTZ CP |
-24.43 |
05 methylammonium ... methylamine (1.50) |
MP2/cc-pVTZ CP |
-18.34 |
05 methylammonium ... methylamine (2.00) |
MP2/cc-pVTZ CP |
-10.1 |
06 methylammonium ... methanol (0.90) |
MP2/cc-pVTZ CP |
-19.85 |
06 methylammonium ... methanol (0.95) |
MP2/cc-pVTZ CP |
-20.9 |
06 methylammonium ... methanol (1.00) |
MP2/cc-pVTZ CP |
-21.23 |
06 methylammonium ... methanol (1.05) |
MP2/cc-pVTZ CP |
-21.04 |
06 methylammonium ... methanol (1.10) |
MP2/cc-pVTZ CP |
-20.53 |
06 methylammonium ... methanol (1.25) |
MP2/cc-pVTZ CP |
-18.02 |
06 methylammonium ... methanol (1.50) |
MP2/cc-pVTZ CP |
-13.54 |
06 methylammonium ... methanol (2.00) |
MP2/cc-pVTZ CP |
-7.89 |
07 methylammonium ... water (0.90) |
MP2/cc-pVTZ CP |
-17.29 |
07 methylammonium ... water (0.95) |
MP2/cc-pVTZ CP |
-18.24 |
07 methylammonium ... water (1.00) |
MP2/cc-pVTZ CP |
-18.51 |
07 methylammonium ... water (1.05) |
MP2/cc-pVTZ CP |
-18.34 |
07 methylammonium ... water (1.10) |
MP2/cc-pVTZ CP |
-17.87 |
07 methylammonium ... water (1.25) |
MP2/cc-pVTZ CP |
-15.65 |
07 methylammonium ... water (1.50) |
MP2/cc-pVTZ CP |
-11.8 |
07 methylammonium ... water (2.00) |
MP2/cc-pVTZ CP |
-7.03 |
08 guanidinium ... formaldehyde (0.90) |
MP2/cc-pVTZ CP |
-16.51 |
08 guanidinium ... formaldehyde (0.95) |
MP2/cc-pVTZ CP |
-17.83 |
08 guanidinium ... formaldehyde (1.00) |
MP2/cc-pVTZ CP |
-18.09 |
08 guanidinium ... formaldehyde (1.05) |
MP2/cc-pVTZ CP |
-17.72 |
08 guanidinium ... formaldehyde (1.10) |
MP2/cc-pVTZ CP |
-17.01 |
08 guanidinium ... formaldehyde (1.25) |
MP2/cc-pVTZ CP |
-14.21 |
08 guanidinium ... formaldehyde (1.50) |
MP2/cc-pVTZ CP |
-10.18 |
08 guanidinium ... formaldehyde (2.00) |
MP2/cc-pVTZ CP |
-5.93 |
09 guanidinium ... methylamine (0.90) |
MP2/cc-pVTZ CP |
-19.05 |
09 guanidinium ... methylamine (0.95) |
MP2/cc-pVTZ CP |
-19.96 |
09 guanidinium ... methylamine (1.00) |
MP2/cc-pVTZ CP |
-20.2 |
09 guanidinium ... methylamine (1.05) |
MP2/cc-pVTZ CP |
-19.98 |
09 guanidinium ... methylamine (1.10) |
MP2/cc-pVTZ CP |
-19.47 |
09 guanidinium ... methylamine (1.25) |
MP2/cc-pVTZ CP |
-17.03 |
09 guanidinium ... methylamine (1.50) |
MP2/cc-pVTZ CP |
-12.65 |
09 guanidinium ... methylamine (2.00) |
MP2/cc-pVTZ CP |
-7.04 |
10 guanidinium ... methanol (0.90) |
MP2/cc-pVTZ CP |
-18.02 |
10 guanidinium ... methanol (0.95) |
MP2/cc-pVTZ CP |
-19.49 |
10 guanidinium ... methanol (1.00) |
MP2/cc-pVTZ CP |
-19.79 |
10 guanidinium ... methanol (1.05) |
MP2/cc-pVTZ CP |
-19.39 |
10 guanidinium ... methanol (1.10) |
MP2/cc-pVTZ CP |
-18.59 |
10 guanidinium ... methanol (1.25) |
MP2/cc-pVTZ CP |
-15.39 |
10 guanidinium ... methanol (1.50) |
MP2/cc-pVTZ CP |
-10.69 |
10 guanidinium ... methanol (2.00) |
MP2/cc-pVTZ CP |
-5.78 |
11 guanidinium ... water (0.90) |
MP2/cc-pVTZ CP |
-15.99 |
11 guanidinium ... water (0.95) |
MP2/cc-pVTZ CP |
-17.25 |
11 guanidinium ... water (1.00) |
MP2/cc-pVTZ CP |
-17.47 |
11 guanidinium ... water (1.05) |
MP2/cc-pVTZ CP |
-17.08 |
11 guanidinium ... water (1.10) |
MP2/cc-pVTZ CP |
-16.36 |
11 guanidinium ... water (1.25) |
MP2/cc-pVTZ CP |
-13.54 |
11 guanidinium ... water (1.50) |
MP2/cc-pVTZ CP |
-9.5 |
11 guanidinium ... water (2.00) |
MP2/cc-pVTZ CP |
-5.29 |
12 imidazolium ... formaldehyde (0.90) |
MP2/cc-pVTZ CP |
-15.31 |
12 imidazolium ... formaldehyde (0.95) |
MP2/cc-pVTZ CP |
-16.17 |
12 imidazolium ... formaldehyde (1.00) |
MP2/cc-pVTZ CP |
-16.41 |
12 imidazolium ... formaldehyde (1.05) |
MP2/cc-pVTZ CP |
-16.24 |
12 imidazolium ... formaldehyde (1.10) |
MP2/cc-pVTZ CP |
-15.81 |
12 imidazolium ... formaldehyde (1.25) |
MP2/cc-pVTZ CP |
-13.8 |
12 imidazolium ... formaldehyde (1.50) |
MP2/cc-pVTZ CP |
-10.4 |
12 imidazolium ... formaldehyde (2.00) |
MP2/cc-pVTZ CP |
-6.27 |
13 imidazolium ... methylamine (0.90) |
MP2/cc-pVTZ CP |
-24.37 |
13 imidazolium ... methylamine (0.95) |
MP2/cc-pVTZ CP |
-25.59 |
13 imidazolium ... methylamine (1.00) |
MP2/cc-pVTZ CP |
-25.98 |
13 imidazolium ... methylamine (1.05) |
MP2/cc-pVTZ CP |
-25.78 |
13 imidazolium ... methylamine (1.10) |
MP2/cc-pVTZ CP |
-25.19 |
13 imidazolium ... methylamine (1.25) |
MP2/cc-pVTZ CP |
-22.18 |
13 imidazolium ... methylamine (1.50) |
MP2/cc-pVTZ CP |
-16.48 |
13 imidazolium ... methylamine (2.00) |
MP2/cc-pVTZ CP |
-8.89 |
14 imidazolium ... methanol (0.90) |
MP2/cc-pVTZ CP |
-17.54 |
14 imidazolium ... methanol (0.95) |
MP2/cc-pVTZ CP |
-18.58 |
14 imidazolium ... methanol (1.00) |
MP2/cc-pVTZ CP |
-18.91 |
14 imidazolium ... methanol (1.05) |
MP2/cc-pVTZ CP |
-18.76 |
14 imidazolium ... methanol (1.10) |
MP2/cc-pVTZ CP |
-18.29 |
14 imidazolium ... methanol (1.25) |
MP2/cc-pVTZ CP |
-15.97 |
14 imidazolium ... methanol (1.50) |
MP2/cc-pVTZ CP |
-11.87 |
14 imidazolium ... methanol (2.00) |
MP2/cc-pVTZ CP |
-6.81 |
15 imidazolium ... water (0.90) |
MP2/cc-pVTZ CP |
-15.21 |
15 imidazolium ... water (0.95) |
MP2/cc-pVTZ CP |
-16.18 |
15 imidazolium ... water (1.00) |
MP2/cc-pVTZ CP |
-16.49 |
15 imidazolium ... water (1.05) |
MP2/cc-pVTZ CP |
-16.36 |
15 imidazolium ... water (1.10) |
MP2/cc-pVTZ CP |
-15.94 |
15 imidazolium ... water (1.25) |
MP2/cc-pVTZ CP |
-13.91 |
15 imidazolium ... water (1.50) |
MP2/cc-pVTZ CP |
-10.38 |
15 imidazolium ... water (2.00) |
MP2/cc-pVTZ CP |
-6.1 |