TF5
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C10 | C11 | doub | 1.40Å | 1.40Å | Aromatic |
| C10 | C9 | sing | 1.40Å | 1.38Å | Aromatic |
| C10 | H10 | sing | 1.09Å | 1.08Å | |
| C17 | C16 | sing | 1.52Å | 1.51Å | |
| C17 | O20 | sing | 1.42Å | 1.22Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C16 | O | sing | 1.43Å | 1.42Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C8 | C9 | doub | 1.39Å | 1.38Å | Aromatic |
| C8 | C7 | sing | 1.40Å | 1.39Å | Aromatic |
| C8 | F13 | sing | 1.34Å | 1.33Å | |
| C7 | C6 | doub | 1.39Å | 1.37Å | Aromatic |
| C7 | F | sing | 1.34Å | 1.36Å | |
| C5 | C4 | doub | 1.39Å | 1.38Å | Aromatic |
| C5 | C | sing | 1.39Å | 1.39Å | Aromatic |
| C5 | H5 | sing | 1.09Å | 1.08Å | |
| C4 | C3 | sing | 1.40Å | 1.39Å | Aromatic |
| C4 | H4 | sing | 1.09Å | 1.08Å | |
| C3 | O | sing | 1.36Å | 1.38Å | |
| C3 | C2 | doub | 1.39Å | 1.39Å | Aromatic |
| C2 | C1 | sing | 1.39Å | 1.39Å | Aromatic |
| C2 | C6 | sing | 1.45Å | 1.49Å | Aromatic |
| C | C1 | doub | 1.39Å | 1.39Å | Aromatic |
| C | H | sing | 1.09Å | 1.08Å | |
| C9 | F14 | sing | 1.34Å | 1.36Å | |
| C11 | C6 | sing | 1.39Å | 1.39Å | Aromatic |
| C11 | H11 | sing | 1.09Å | 1.08Å | |
| C1 | H1 | sing | 1.09Å | 1.08Å | |
| O20 | HO20 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C11 | C10 | C9 | 119.5° | 120.0° |
| C11 | C10 | H10 | 120.2° | 120.0° |
| C10 | C11 | C6 | 120.6° | 119.9° |
| C10 | C11 | H11 | 119.7° | 119.1° |
| C9 | C10 | H10 | 120.2° | 120.0° |
| C10 | C9 | C8 | 119.3° | 120.0° |
| C10 | C9 | F14 | 120.5° | 120.0° |
| C16 | C17 | O20 | 108.8° | 109.1° |
| C16 | C17 | H171 | 109.7° | 111.1° |
| C16 | C17 | H172 | 109.8° | 110.5° |
| C17 | C16 | O | 109.2° | 109.0° |
| C17 | C16 | H161 | 109.5° | 111.1° |
| C17 | C16 | H162 | 109.6° | 110.5° |
| O20 | C17 | H171 | 109.7° | 108.2° |
| O20 | C17 | H172 | 109.8° | 108.3° |
| C17 | O20 | HO20 | 109.5° | 106.7° |
| H171 | C17 | H172 | 109.0° | 109.7° |
| O | C16 | H161 | 109.5° | 108.1° |
| O | C16 | H162 | 109.6° | 108.2° |
| C16 | O | C3 | 124.4° | 117.0° |
| H161 | C16 | H162 | 109.3° | 109.7° |
| C9 | C8 | C7 | 121.4° | 120.0° |
| C9 | C8 | F13 | 116.7° | 120.0° |
| C8 | C9 | F14 | 120.2° | 120.0° |
| C7 | C8 | F13 | 121.9° | 120.0° |
| C8 | C7 | C6 | 119.5° | 119.9° |
| C8 | C7 | F | 124.6° | 119.3° |
| C6 | C7 | F | 115.9° | 120.8° |
| C7 | C6 | C2 | 120.6° | 120.1° |
| C7 | C6 | C11 | 119.7° | 120.2° |
| C4 | C5 | C | 120.8° | 120.0° |
| C4 | C5 | H5 | 119.6° | 120.0° |
| C5 | C4 | C3 | 119.1° | 120.0° |
| C5 | C4 | H4 | 120.4° | 119.6° |
| C | C5 | H5 | 119.6° | 120.0° |
| C5 | C | C1 | 120.1° | 120.0° |
| C5 | C | H | 120.0° | 120.0° |
| C3 | C4 | H4 | 120.4° | 120.4° |
| C4 | C3 | O | 121.3° | 118.7° |
| C4 | C3 | C2 | 120.4° | 120.0° |
| O | C3 | C2 | 118.2° | 121.3° |
| C3 | C2 | C1 | 120.4° | 120.0° |
| C3 | C2 | C6 | 117.8° | 120.8° |
| C1 | C2 | C6 | 121.7° | 119.1° |
| C2 | C1 | C | 119.1° | 120.0° |
| C2 | C1 | H1 | 120.4° | 120.9° |
| C2 | C6 | C11 | 119.7° | 119.7° |
| C1 | C | H | 119.9° | 120.0° |
| C | C1 | H1 | 120.4° | 119.1° |
| C6 | C11 | H11 | 119.7° | 121.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C11 | C10 | C9 | H10 | 180.0° | 180.0° |
| C11 | C10 | C9 | C8 | 0.7° | 0.0° |
| C10 | C11 | C6 | C7 | 0.2° | 0.0° |
| C10 | C11 | C6 | C2 | 178.4° | 180.0° |
| C11 | C10 | C9 | F14 | 179.9° | 179.9° |
| C10 | C11 | C6 | H11 | 180.0° | 179.9° |
| C10 | C9 | C8 | F14 | 179.4° | 179.9° |
| C10 | C9 | C8 | C7 | 1.3° | 0.0° |
| C10 | C9 | C8 | F13 | 179.6° | 180.0° |
| C9 | C10 | C11 | C6 | 0.2° | 0.0° |
| C9 | C10 | C11 | H11 | 179.8° | 180.0° |
| H10 | C10 | C9 | C8 | 179.3° | 180.0° |
| H10 | C10 | C9 | F14 | 0.1° | 0.0° |
| H10 | C10 | C11 | C6 | 179.8° | 180.0° |
| H10 | C10 | C11 | H11 | 0.2° | 0.1° |
| C16 | C17 | O20 | H171 | 120.0° | 121.0° |
| C16 | C17 | O20 | H172 | 120.2° | 120.2° |
| C16 | C17 | H171 | H172 | 120.3° | 122.4° |
| C17 | C16 | O | H161 | 120.0° | 120.9° |
| C17 | C16 | O | H162 | 120.1° | 120.3° |
| C17 | C16 | H161 | H162 | 120.1° | 122.5° |
| C17 | C16 | O | C3 | 170.2° | 150.9° |
| C16 | C17 | O20 | HO20 | 100.7° | 84.3° |
| O20 | C17 | H171 | H172 | 120.3° | 117.9° |
| O20 | C17 | C16 | O | 130.2° | 59.1° |
| O20 | C17 | C16 | H161 | 109.8° | 60.0° |
| O20 | C17 | C16 | H162 | 10.1° | 178.0° |
| H171 | C17 | C16 | O | 109.8° | 60.0° |
| H171 | C17 | C16 | H161 | 10.2° | 179.1° |
| H171 | C17 | C16 | H162 | 130.1° | 58.8° |
| H171 | C17 | O20 | HO20 | 139.3° | 36.7° |
| H172 | C17 | C16 | O | 10.0° | 178.0° |
| H172 | C17 | C16 | H161 | 130.0° | 58.9° |
| H172 | C17 | C16 | H162 | 110.1° | 63.1° |
| H172 | C17 | O20 | HO20 | 19.5° | 155.5° |
| O | C16 | H161 | H162 | 120.1° | 117.8° |
| C16 | O | C3 | C4 | 32.5° | 60.0° |
| C16 | O | C3 | C2 | 149.7° | 120.1° |
| H161 | C16 | O | C3 | 69.8° | 30.0° |
| H162 | C16 | O | C3 | 50.1° | 88.8° |
| C9 | C8 | C7 | F13 | 178.2° | 180.0° |
| C9 | C8 | C7 | C6 | 1.3° | 0.0° |
| C9 | C8 | C7 | F | 179.7° | 180.0° |
| C8 | C7 | C6 | F | 179.1° | 179.9° |
| C8 | C7 | C6 | C2 | 178.9° | 180.0° |
| C7 | C8 | C9 | F14 | 179.3° | 179.9° |
| C8 | C7 | C6 | C11 | 0.8° | 0.0° |
| F13 | C8 | C7 | C6 | 179.5° | 180.0° |
| F13 | C8 | C7 | F | 1.5° | 0.1° |
| F13 | C8 | C9 | F14 | 1.1° | 0.0° |
| C7 | C6 | C2 | C3 | 52.9° | 90.1° |
| C7 | C6 | C2 | C1 | 130.1° | 90.0° |
| C7 | C6 | C2 | C11 | 178.1° | 180.0° |
| C7 | C6 | C11 | H11 | 179.8° | 180.0° |
| F | C7 | C6 | C2 | 2.0° | 0.0° |
| F | C7 | C6 | C11 | 179.9° | 180.0° |
| C4 | C5 | C | H5 | 180.0° | 179.9° |
| C5 | C4 | C3 | H4 | 180.0° | 180.0° |
| C5 | C4 | C3 | O | 179.2° | 179.9° |
| C5 | C4 | C3 | C2 | 1.5° | 0.0° |
| C4 | C5 | C | C1 | 0.5° | 0.0° |
| C4 | C5 | C | H | 179.5° | 179.9° |
| C | C5 | C4 | C3 | 0.3° | 0.0° |
| C | C5 | C4 | H4 | 179.7° | 180.0° |
| C5 | C | C1 | C2 | 0.2° | 0.0° |
| C5 | C | C1 | H | 180.0° | 179.9° |
| C5 | C | C1 | H1 | 179.8° | 180.0° |
| H5 | C5 | C4 | C3 | 179.7° | 179.9° |
| H5 | C5 | C4 | H4 | 0.3° | 0.0° |
| H5 | C5 | C | C1 | 179.5° | 179.9° |
| H5 | C5 | C | H | 0.5° | 0.0° |
| C4 | C3 | O | C2 | 177.7° | 179.9° |
| C4 | C3 | C2 | C1 | 1.8° | 0.0° |
| C4 | C3 | C2 | C6 | 178.9° | 180.0° |
| H4 | C4 | C3 | O | 0.8° | 0.1° |
| H4 | C4 | C3 | C2 | 178.5° | 180.0° |
| O | C3 | C2 | C1 | 179.6° | 179.9° |
| O | C3 | C2 | C6 | 3.3° | 0.0° |
| C3 | C2 | C1 | C6 | 177.0° | 179.9° |
| C3 | C2 | C1 | C | 0.9° | 0.0° |
| C3 | C2 | C6 | C11 | 125.2° | 89.9° |
| C3 | C2 | C1 | H1 | 179.1° | 180.0° |
| C2 | C1 | C | H1 | 180.0° | 179.9° |
| C2 | C1 | C | H | 179.8° | 179.9° |
| C1 | C2 | C6 | C11 | 51.8° | 90.0° |
| C6 | C2 | C1 | C | 177.9° | 180.0° |
| C2 | C6 | C11 | H11 | 1.6° | 0.0° |
| C6 | C2 | C1 | H1 | 2.1° | 0.1° |
| H | C | C1 | H1 | 0.2° | 0.0° |
