F50
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | O | doub | 1.21Å | 1.25Å | |
| C | OXT | sing | 1.34Å | 1.45Å | |
| C | CH3 | sing | 1.51Å | 1.48Å | |
| OX1 | OXT | sing | 1.26Å | 1.49Å | |
| OX1 | HX1 | sing | 0.97Å | 0.95Å | |
| CH3 | HH31 | sing | 1.09Å | 1.10Å | |
| CH3 | HH32 | sing | 1.09Å | 1.10Å | |
| CH3 | HH33 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O | C | OXT | 122.1° | 120.0° |
| O | C | CH3 | 122.7° | 120.0° |
| OXT | C | CH3 | 115.2° | 120.0° |
| C | OXT | OX1 | 127.1° | 119.9° |
| C | CH3 | HH31 | 109.5° | 109.5° |
| C | CH3 | HH32 | 109.5° | 109.5° |
| C | CH3 | HH33 | 109.5° | 109.5° |
| OXT | OX1 | HX1 | 109.5° | 106.7° |
| HH31 | CH3 | HH32 | 109.5° | 109.5° |
| HH31 | CH3 | HH33 | 109.4° | 109.5° |
| HH32 | CH3 | HH33 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C | OXT | CH3 | 177.4° | 180.0° |
| O | C | OXT | OX1 | 89.3° | 0.0° |
| O | C | CH3 | HH31 | 117.9° | 90.0° |
| O | C | CH3 | HH32 | 122.1° | 150.0° |
| O | C | CH3 | HH33 | 2.1° | 30.0° |
| C | OXT | OX1 | HX1 | 117.4° | 180.0° |
| OXT | C | CH3 | HH31 | 64.7° | 90.0° |
| OXT | C | CH3 | HH32 | 55.3° | 30.0° |
| OXT | C | CH3 | HH33 | 175.3° | 150.0° |
| CH3 | C | OXT | OX1 | 93.3° | 180.0° |
| C | CH3 | HH31 | HH32 | 120.0° | 120.0° |
| C | CH3 | HH31 | HH33 | 120.0° | 120.0° |
| C | CH3 | HH32 | HH33 | 120.0° | 120.0° |
| HH31 | CH3 | HH32 | HH33 | 120.0° | 120.0° |
