U5V
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C30 | C31 | doub | 1.38Å | 1.39Å | Aromatic |
| C30 | C29 | sing | 1.38Å | 1.39Å | Aromatic |
| C31 | C25 | sing | 1.38Å | 1.39Å | Aromatic |
| C29 | C28 | doub | 1.38Å | 1.39Å | Aromatic |
| C25 | C24 | sing | 1.51Å | 1.54Å | |
| C25 | C26 | doub | 1.38Å | 1.39Å | Aromatic |
| C28 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
| C24 | N23 | sing | 1.47Å | 1.45Å | |
| C26 | F27 | sing | 1.35Å | 1.36Å | |
| C24 | H8 | sing | 1.09Å | 1.10Å | |
| C24 | H9 | sing | 1.09Å | 1.10Å | |
| C28 | H10 | sing | 1.08Å | 1.08Å | |
| C29 | H20 | sing | 1.08Å | 1.08Å | |
| C30 | H21 | sing | 1.08Å | 1.08Å | |
| C31 | H22 | sing | 1.08Å | 1.08Å | |
| N23 | H39 | sing | 1.01Å | 1.00Å | |
| N23 | H2 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C31 | C30 | C29 | 120.3° | 120.1° |
| C30 | C31 | C25 | 120.0° | 120.0° |
| C31 | C30 | H21 | 119.9° | 120.0° |
| C30 | C31 | H22 | 120.0° | 120.0° |
| C30 | C29 | C28 | 119.8° | 120.0° |
| C30 | C29 | H20 | 120.1° | 120.0° |
| C29 | C30 | H21 | 119.9° | 120.0° |
| C31 | C25 | C24 | 120.2° | 120.0° |
| C31 | C25 | C26 | 119.8° | 120.0° |
| C25 | C31 | H22 | 120.0° | 120.0° |
| C29 | C28 | C26 | 119.9° | 120.0° |
| C29 | C28 | H10 | 120.0° | 120.0° |
| C28 | C29 | H20 | 120.1° | 120.0° |
| C24 | C25 | C26 | 120.1° | 120.0° |
| C25 | C24 | N23 | 109.2° | 109.5° |
| C25 | C24 | H8 | 109.5° | 109.5° |
| C25 | C24 | H9 | 109.5° | 109.5° |
| C25 | C26 | C28 | 120.3° | 119.9° |
| C25 | C26 | F27 | 119.5° | 120.1° |
| C28 | C26 | F27 | 120.2° | 120.0° |
| C26 | C28 | H10 | 120.0° | 120.0° |
| N23 | C24 | H8 | 109.5° | 109.5° |
| N23 | C24 | H9 | 109.5° | 109.5° |
| C24 | N23 | H39 | 109.5° | 111.0° |
| C24 | N23 | H2 | 109.4° | 111.0° |
| H8 | C24 | H9 | 109.5° | 109.4° |
| H39 | N23 | H2 | 109.5° | 110.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C31 | C30 | C29 | H21 | 180.0° | 179.7° |
| C30 | C31 | C25 | H22 | 180.0° | 179.7° |
| C31 | C30 | C29 | C28 | 0.4° | 0.2° |
| C30 | C31 | C25 | C24 | 180.0° | 180.0° |
| C30 | C31 | C25 | C26 | 0.2° | 0.0° |
| C31 | C30 | C29 | H20 | 179.6° | 179.7° |
| C29 | C30 | C31 | C25 | 0.1° | 0.3° |
| C30 | C29 | C28 | H20 | 180.0° | 179.9° |
| C30 | C29 | C28 | C26 | 0.7° | 0.0° |
| C30 | C29 | C28 | H10 | 179.3° | 180.0° |
| C29 | C30 | C31 | H22 | 179.9° | 180.0° |
| C31 | C25 | C24 | C26 | 179.8° | 180.0° |
| C31 | C25 | C26 | C28 | 0.1° | 0.2° |
| C31 | C25 | C24 | N23 | 98.2° | 100.0° |
| C31 | C25 | C26 | F27 | 179.7° | 179.9° |
| C31 | C25 | C24 | H8 | 141.8° | 20.0° |
| C31 | C25 | C24 | H9 | 21.7° | 140.0° |
| C25 | C31 | C30 | H21 | 179.9° | 180.0° |
| C29 | C28 | C26 | C25 | 0.5° | 0.3° |
| C29 | C28 | C26 | H10 | 180.0° | 180.0° |
| C29 | C28 | C26 | F27 | 179.3° | 179.9° |
| C28 | C29 | C30 | H21 | 179.6° | 180.0° |
| C24 | C25 | C26 | C28 | 179.7° | 179.7° |
| C25 | C24 | N23 | H8 | 119.9° | 120.0° |
| C25 | C24 | N23 | H9 | 120.0° | 120.0° |
| C24 | C25 | C26 | F27 | 0.5° | 0.1° |
| C25 | C24 | H8 | H9 | 120.1° | 120.0° |
| C24 | C25 | C31 | H22 | 0.0° | 0.3° |
| C25 | C24 | N23 | H39 | 180.0° | 56.1° |
| C25 | C24 | N23 | H2 | 60.0° | 180.0° |
| C25 | C26 | C28 | F27 | 179.8° | 179.7° |
| C26 | C25 | C24 | N23 | 81.5° | 80.0° |
| C26 | C25 | C24 | H8 | 38.4° | 160.0° |
| C26 | C25 | C24 | H9 | 158.5° | 40.0° |
| C25 | C26 | C28 | H10 | 179.5° | 179.7° |
| C26 | C25 | C31 | H22 | 179.8° | 179.7° |
| C26 | C28 | C29 | H20 | 179.3° | 180.0° |
| N23 | C24 | H8 | H9 | 120.1° | 120.0° |
| C24 | N23 | H39 | H2 | 120.0° | 123.9° |
| F27 | C26 | C28 | H10 | 0.7° | 0.0° |
| H8 | C24 | N23 | H39 | 60.0° | 63.9° |
| H8 | C24 | N23 | H2 | 179.9° | 60.0° |
| H9 | C24 | N23 | H39 | 60.0° | 176.1° |
| H9 | C24 | N23 | H2 | 60.0° | 60.0° |
| H10 | C28 | C29 | H20 | 0.7° | 0.0° |
| H20 | C29 | C30 | H21 | 0.4° | 0.0° |
| H21 | C30 | C31 | H22 | 0.1° | 0.3° |
