Bonding Atoms | Molecular Mechanics | Semi-Empirical | ab intio |
MM2 | AM1 | HF (STO-3G) | |
H1-O1 | 0.492 | 0.961 | |
H2-O1 | 0.492 | 0.961 |
Vertex Atom | Angle Atoms | Molecular Mechanics | Semi-Empirical | ab intio | Experimental |
MM2 | AM1 | HF (STO-3G) | |||
O1 | H1-O1-H2 | 104.5 | 103.5 | 104.5 |