RF2
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C6 | C7 | doub | 1.40Å | 1.40Å | Aromatic |
| C6 | C5 | sing | 1.38Å | 1.40Å | Aromatic |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C5 | C4 | doub | 1.39Å | 1.40Å | Aromatic |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C4 | C3 | sing | 1.39Å | 1.39Å | Aromatic |
| C4 | F | sing | 1.35Å | 1.35Å | |
| C8 | C3 | doub | 1.38Å | 1.40Å | Aromatic |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C7 | C8 | sing | 1.40Å | 1.39Å | Aromatic |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C2 | C7 | sing | 1.48Å | 1.41Å | Aromatic |
| N2 | C2 | doub | 1.32Å | 1.35Å | Aromatic |
| C2 | N3 | sing | 1.37Å | 1.34Å | Aromatic |
| C1 | N3 | sing | 1.37Å | 1.34Å | Aromatic |
| N1 | N2 | sing | 1.29Å | 1.26Å | Aromatic |
| N1 | C1 | doub | 1.32Å | 1.36Å | Aromatic |
| C9 | C1 | sing | 1.48Å | 1.40Å | Aromatic |
| C10 | C9 | doub | 1.40Å | 1.40Å | Aromatic |
| C9 | C14 | sing | 1.39Å | 1.39Å | Aromatic |
| C11 | C10 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C11 | C12 | doub | 1.38Å | 1.39Å | Aromatic |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| C12 | C13 | sing | 1.38Å | 1.40Å | Aromatic |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C13 | C14 | doub | 1.38Å | 1.40Å | Aromatic |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| N3 | HN3 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C7 | C6 | C5 | 122.4° | 119.9° |
| C7 | C6 | H6 | 118.8° | 120.1° |
| C6 | C7 | C8 | 118.5° | 119.8° |
| C6 | C7 | C2 | 119.9° | 120.1° |
| C5 | C6 | H6 | 118.8° | 120.1° |
| C6 | C5 | C4 | 118.0° | 120.1° |
| C6 | C5 | H5 | 121.0° | 119.9° |
| C4 | C5 | H5 | 121.0° | 120.0° |
| C5 | C4 | C3 | 120.2° | 120.2° |
| C5 | C4 | F | 119.2° | 119.9° |
| C3 | C4 | F | 120.6° | 119.9° |
| C4 | C3 | C8 | 121.1° | 120.1° |
| C4 | C3 | H3 | 119.4° | 120.0° |
| C8 | C3 | H3 | 119.5° | 119.9° |
| C3 | C8 | C7 | 119.8° | 119.9° |
| C3 | C8 | H8 | 120.1° | 120.1° |
| C7 | C8 | H8 | 120.1° | 120.0° |
| C8 | C7 | C2 | 121.4° | 120.2° |
| C7 | C2 | N2 | 126.6° | 126.4° |
| C7 | C2 | N3 | 127.0° | 126.4° |
| N2 | C2 | N3 | 106.2° | 107.2° |
| C2 | N2 | N1 | 110.8° | 109.9° |
| C2 | N3 | C1 | 107.7° | 105.7° |
| C2 | N3 | HN3 | 126.2° | 127.2° |
| N3 | C1 | N1 | 107.2° | 107.2° |
| N3 | C1 | C9 | 125.4° | 126.5° |
| C1 | N3 | HN3 | 126.2° | 127.1° |
| N2 | N1 | C1 | 108.0° | 109.9° |
| N1 | C1 | C9 | 126.9° | 126.3° |
| C1 | C9 | C10 | 118.4° | 120.1° |
| C1 | C9 | C14 | 122.4° | 120.2° |
| C10 | C9 | C14 | 118.7° | 119.7° |
| C9 | C10 | C11 | 122.2° | 119.8° |
| C9 | C10 | H10 | 118.9° | 120.1° |
| C9 | C14 | C13 | 119.3° | 119.9° |
| C9 | C14 | H14 | 120.4° | 120.1° |
| C11 | C10 | H10 | 118.9° | 120.1° |
| C10 | C11 | C12 | 118.7° | 120.1° |
| C10 | C11 | H11 | 120.7° | 119.9° |
| C12 | C11 | H11 | 120.6° | 119.9° |
| C11 | C12 | C13 | 119.6° | 120.3° |
| C11 | C12 | H12 | 120.2° | 119.9° |
| C13 | C12 | H12 | 120.2° | 119.8° |
| C12 | C13 | C14 | 121.4° | 120.1° |
| C12 | C13 | H13 | 119.3° | 119.9° |
| C14 | C13 | H13 | 119.3° | 120.0° |
| C13 | C14 | H14 | 120.3° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C7 | C6 | C5 | H6 | 180.0° | 179.8° |
| C7 | C6 | C5 | C4 | 0.4° | 0.0° |
| C7 | C6 | C5 | H5 | 179.6° | 180.0° |
| C6 | C7 | C8 | C3 | 2.5° | 0.0° |
| C6 | C7 | C8 | C2 | 175.1° | 180.0° |
| C6 | C7 | C8 | H8 | 177.5° | 180.0° |
| C6 | C7 | C2 | N2 | 2.3° | 0.3° |
| C6 | C7 | C2 | N3 | 176.9° | 180.0° |
| C6 | C5 | C4 | H5 | 180.0° | 180.0° |
| C6 | C5 | C4 | C3 | 1.3° | 0.0° |
| C6 | C5 | C4 | F | 179.2° | 180.0° |
| C5 | C6 | C7 | C8 | 2.3° | 0.0° |
| C5 | C6 | C7 | C2 | 177.4° | 180.0° |
| H6 | C6 | C5 | C4 | 179.6° | 179.8° |
| H6 | C6 | C5 | H5 | 0.4° | 0.2° |
| H6 | C6 | C7 | C8 | 177.7° | 179.7° |
| H6 | C6 | C7 | C2 | 2.6° | 0.2° |
| C5 | C4 | C3 | F | 179.5° | 180.0° |
| C5 | C4 | C3 | C8 | 1.1° | 0.0° |
| C5 | C4 | C3 | H3 | 178.9° | 180.0° |
| H5 | C5 | C4 | C3 | 178.7° | 179.9° |
| H5 | C5 | C4 | F | 0.8° | 0.0° |
| C4 | C3 | C8 | H3 | 180.0° | 180.0° |
| C4 | C3 | C8 | C7 | 0.9° | 0.0° |
| C4 | C3 | C8 | H8 | 179.1° | 179.9° |
| F | C4 | C3 | C8 | 179.4° | 180.0° |
| F | C4 | C3 | H3 | 0.6° | 0.0° |
| C3 | C8 | C7 | H8 | 180.0° | 179.9° |
| C3 | C8 | C7 | C2 | 177.5° | 180.0° |
| H3 | C3 | C8 | C7 | 179.1° | 180.0° |
| H3 | C3 | C8 | H8 | 0.9° | 0.0° |
| C8 | C7 | C2 | N2 | 172.7° | 179.7° |
| C8 | C7 | C2 | N3 | 1.9° | 0.1° |
| H8 | C8 | C7 | C2 | 2.5° | 0.1° |
| C7 | C2 | N2 | N3 | 175.5° | 179.8° |
| C7 | C2 | N3 | C1 | 177.6° | 180.0° |
| C7 | C2 | N2 | N1 | 176.2° | 179.9° |
| C7 | C2 | N3 | HN3 | 2.4° | 0.1° |
| N2 | C2 | N3 | C1 | 2.1° | 0.2° |
| C2 | N2 | N1 | C1 | 1.1° | 0.2° |
| N2 | C2 | N3 | HN3 | 177.9° | 179.7° |
| C2 | N3 | C1 | HN3 | 180.0° | 179.9° |
| N3 | C2 | N2 | N1 | 0.6° | 0.3° |
| C2 | N3 | C1 | N1 | 2.7° | 0.1° |
| C2 | N3 | C1 | C9 | 174.8° | 179.9° |
| N3 | C1 | N1 | N2 | 2.3° | 0.1° |
| N3 | C1 | N1 | C9 | 172.0° | 179.9° |
| N3 | C1 | C9 | C10 | 158.4° | 0.3° |
| N3 | C1 | C9 | C14 | 12.8° | 180.0° |
| N2 | N1 | C1 | C9 | 174.3° | 180.0° |
| N1 | C1 | C9 | C10 | 12.2° | 179.8° |
| N1 | C1 | C9 | C14 | 176.6° | 0.0° |
| N1 | C1 | N3 | HN3 | 177.3° | 179.8° |
| C1 | C9 | C10 | C14 | 171.5° | 179.7° |
| C1 | C9 | C10 | C11 | 176.1° | 180.0° |
| C1 | C9 | C10 | H10 | 3.9° | 0.0° |
| C1 | C9 | C14 | C13 | 175.7° | 179.7° |
| C1 | C9 | C14 | H14 | 4.3° | 0.0° |
| C9 | C1 | N3 | HN3 | 5.1° | 0.2° |
| C9 | C10 | C11 | H10 | 180.0° | 180.0° |
| C9 | C10 | C11 | C12 | 2.0° | 0.0° |
| C9 | C10 | C11 | H11 | 178.0° | 179.9° |
| C10 | C9 | C14 | C13 | 4.6° | 0.6° |
| C10 | C9 | C14 | H14 | 175.5° | 179.7° |
| C14 | C9 | C10 | C11 | 4.6° | 0.3° |
| C14 | C9 | C10 | H10 | 175.4° | 179.8° |
| C9 | C14 | C13 | C12 | 2.2° | 0.6° |
| C9 | C14 | C13 | H14 | 180.0° | 179.7° |
| C9 | C14 | C13 | H13 | 177.8° | 179.7° |
| C10 | C11 | C12 | H11 | 180.0° | 179.9° |
| C10 | C11 | C12 | C13 | 0.5° | 0.0° |
| C10 | C11 | C12 | H12 | 179.5° | 180.0° |
| H10 | C10 | C11 | C12 | 178.0° | 180.0° |
| H10 | C10 | C11 | H11 | 2.0° | 0.0° |
| C11 | C12 | C13 | H12 | 180.0° | 180.0° |
| C11 | C12 | C13 | C14 | 0.4° | 0.3° |
| C11 | C12 | C13 | H13 | 179.6° | 180.0° |
| H11 | C11 | C12 | C13 | 179.5° | 179.9° |
| H11 | C11 | C12 | H12 | 0.5° | 0.1° |
| C12 | C13 | C14 | H13 | 180.0° | 179.7° |
| C12 | C13 | C14 | H14 | 177.8° | 179.7° |
| H12 | C12 | C13 | C14 | 179.6° | 179.7° |
| H12 | C12 | C13 | H13 | 0.4° | 0.1° |
| H13 | C13 | C14 | H14 | 2.2° | 0.0° |
