1 | nh3 | bh3 | nh3-bh3 | -1 | -1 | 1 | -32.1 | 1.56 | 1.10 | 0.98 |
2 | nh3-bh3 | nh2-bh2 | h2 | -1 | 1 | 1 | -0.2 | -0.62 | -0.32 | -0.30 |
3 | nh2-bh2 | nh-bh | h2 | -1 | 1 | 1 | 37.6 | 0.60 | 0.74 | 0.77 |
4 | nh2-bh2 | cbut | | -2 | 1 | | -19.5 | 3.73 | 2.65 | 2.33 |
5 | nh2-bh2 | bz h2 | | -3 | 1 | 3 | -48.9 | 3.18 | 2.53 | 1.47 |
6 | nh2-bh2 | ch | | -3 | 1 | | -46.1 | 7.06 | 4.32 | 3.68 |
7 | BH3PH3 | BH3 | PH3 | 1 | -1 | -1 | -25.2 | 1.14 | 0.73 | 0.01 |
8 | K_H | BH3PH3 | H2 | 1 | -1 | -1 | 40.4 | -0.44 | -0.85 | -0.77 |
9 | BF3PMe3 | BF3 | PMe3 | 1 | -1 | -1 | -15.2 | 1.48 | 0.41 | -0.35 |
10 | K_F | BF3PMe3 | H2 | 1 | -1 | -1 | 18.5 | -0.04 | -1.30 | -0.13 |
11 | BCl3PMe3 | BCl3 | PMe3 | 1 | -1 | -1 | -31.2 | 4.08 | 1.49 | -0.18 |
12 | K_Cl | BCl3PMe3 | H2 | 1 | -1 | -1 | 17.6 | -1.19 | -1.87 | -0.14 |
MD | | | | | | | | 1.71 | 0.80 | 0.61 |
MAD | | | | | | | | 2.09 | 1.52 | 0.93 |
RMSD | | | | | | | | 2.87 | 1.89 | 1.40 |