FMT
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C | O1 | doub | 1.21Å | 1.64Å | |
C | O2 | sing | 1.34Å | 1.48Å | |
C | H | sing | 1.08Å | 1.08Å | |
O2 | HO2 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O1 | C | O2 | 118.2° | 120.0° |
O1 | C | H | 120.9° | 120.0° |
O2 | C | H | 120.9° | 120.0° |
C | O2 | HO2 | 109.5° | 117.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O1 | C | O2 | H | 180.0° | 179.7° |
O1 | C | O2 | HO2 | 0.0° | 179.9° |
H | C | O2 | HO2 | 180.0° | 0.3° |