N08
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C7 | C8 | sing | 1.51Å | 1.50Å | |
| C7 | C6 | sing | 1.53Å | 1.50Å | |
| C8 | C9 | doub | 1.38Å | 1.39Å | Aromatic |
| C8 | C13 | sing | 1.38Å | 1.38Å | Aromatic |
| C9 | C10 | sing | 1.38Å | 1.38Å | Aromatic |
| C13 | C12 | doub | 1.38Å | 1.38Å | Aromatic |
| C10 | C11 | doub | 1.38Å | 1.37Å | Aromatic |
| C11 | C12 | sing | 1.38Å | 1.37Å | Aromatic |
| C11 | F1 | sing | 1.35Å | 1.36Å | |
| C1 | C2 | sing | 1.40Å | 1.41Å | Aromatic |
| C1 | C4 | doub | 1.35Å | 1.43Å | Aromatic |
| C2 | C3 | doub | 1.37Å | 1.45Å | Aromatic |
| C6 | N1 | sing | 1.46Å | 1.45Å | |
| N1 | C5 | sing | 1.35Å | 1.34Å | |
| C5 | O2 | doub | 1.22Å | 1.23Å | |
| C5 | C3 | sing | 1.47Å | 1.38Å | |
| C3 | O1 | sing | 1.35Å | 1.39Å | Aromatic |
| C4 | O1 | sing | 1.34Å | 1.38Å | Aromatic |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| C4 | H2 | sing | 1.08Å | 1.08Å | |
| C6 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C10 | H7 | sing | 1.08Å | 1.08Å | |
| C13 | H8 | sing | 1.08Å | 1.08Å | |
| C1 | H9 | sing | 1.08Å | 1.08Å | |
| C2 | H10 | sing | 1.08Å | 1.08Å | |
| C9 | H11 | sing | 1.08Å | 1.08Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C8 | C7 | C6 | 108.4° | 109.5° |
| C7 | C8 | C9 | 120.8° | 120.0° |
| C7 | C8 | C13 | 120.2° | 120.0° |
| C8 | C7 | H5 | 109.7° | 109.5° |
| C8 | C7 | H6 | 109.7° | 109.4° |
| C7 | C6 | N1 | 112.8° | 109.5° |
| C7 | C6 | H3 | 108.6° | 109.5° |
| C7 | C6 | H4 | 108.6° | 109.5° |
| C6 | C7 | H5 | 109.8° | 109.5° |
| C6 | C7 | H6 | 109.7° | 109.5° |
| C9 | C8 | C13 | 118.9° | 120.1° |
| C8 | C9 | C10 | 120.6° | 120.0° |
| C8 | C9 | H11 | 119.7° | 120.0° |
| C8 | C13 | C12 | 120.8° | 120.0° |
| C8 | C13 | H8 | 119.6° | 120.1° |
| C9 | C10 | C11 | 118.8° | 120.0° |
| C9 | C10 | H7 | 120.6° | 120.0° |
| C10 | C9 | H11 | 119.7° | 120.0° |
| C13 | C12 | C11 | 118.8° | 120.0° |
| C12 | C13 | H8 | 119.6° | 119.9° |
| C13 | C12 | H12 | 120.6° | 120.0° |
| C10 | C11 | C12 | 122.1° | 119.9° |
| C10 | C11 | F1 | 118.5° | 120.0° |
| C11 | C10 | H7 | 120.6° | 120.1° |
| C12 | C11 | F1 | 119.4° | 120.1° |
| C11 | C12 | H12 | 120.6° | 120.0° |
| C2 | C1 | C4 | 108.7° | 107.2° |
| C1 | C2 | C3 | 105.3° | 106.7° |
| C2 | C1 | H9 | 125.7° | 126.5° |
| C1 | C2 | H10 | 127.4° | 126.7° |
| C1 | C4 | O1 | 107.8° | 108.7° |
| C1 | C4 | H2 | 126.1° | 125.6° |
| C4 | C1 | H9 | 125.6° | 126.4° |
| C2 | C3 | C5 | 132.0° | 126.0° |
| C2 | C3 | O1 | 108.5° | 108.0° |
| C3 | C2 | H10 | 127.4° | 126.6° |
| C6 | N1 | C5 | 121.7° | 120.0° |
| C6 | N1 | H1 | 119.2° | 120.0° |
| N1 | C6 | H3 | 108.7° | 109.4° |
| N1 | C6 | H4 | 108.6° | 109.5° |
| N1 | C5 | O2 | 122.9° | 120.0° |
| N1 | C5 | C3 | 115.9° | 120.0° |
| C5 | N1 | H1 | 119.1° | 119.9° |
| O2 | C5 | C3 | 121.2° | 120.0° |
| C5 | C3 | O1 | 119.5° | 126.0° |
| C3 | O1 | C4 | 109.0° | 109.4° |
| O1 | C4 | H2 | 126.1° | 125.7° |
| H3 | C6 | H4 | 109.4° | 109.5° |
| H5 | C7 | H6 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C8 | C7 | C6 | H5 | 119.8° | 120.0° |
| C8 | C7 | C6 | H6 | 119.8° | 120.0° |
| C7 | C8 | C9 | C13 | 175.5° | 179.7° |
| C7 | C8 | C9 | C10 | 178.5° | 180.0° |
| C7 | C8 | C13 | C12 | 177.0° | 180.0° |
| C8 | C7 | C6 | N1 | 179.7° | 180.0° |
| C8 | C7 | C6 | H3 | 59.2° | 60.0° |
| C8 | C7 | C6 | H4 | 59.8° | 60.0° |
| C8 | C7 | H5 | H6 | 120.5° | 120.0° |
| C7 | C8 | C13 | H8 | 3.0° | 0.1° |
| C7 | C8 | C9 | H11 | 1.5° | 0.1° |
| C6 | C7 | C8 | C9 | 95.8° | 90.0° |
| C6 | C7 | C8 | C13 | 79.7° | 89.7° |
| C7 | C6 | N1 | H3 | 120.5° | 120.1° |
| C7 | C6 | N1 | H4 | 120.5° | 120.0° |
| C7 | C6 | N1 | C5 | 97.9° | 180.0° |
| C7 | C6 | N1 | H1 | 82.0° | 0.2° |
| C7 | C6 | H3 | H4 | 118.5° | 120.0° |
| C6 | C7 | H5 | H6 | 120.5° | 120.0° |
| C8 | C9 | C10 | H11 | 180.0° | 179.9° |
| C9 | C8 | C13 | C12 | 1.4° | 0.3° |
| C8 | C9 | C10 | C11 | 2.6° | 0.1° |
| C9 | C8 | C7 | H5 | 24.1° | 30.0° |
| C9 | C8 | C7 | H6 | 144.4° | 150.0° |
| C8 | C9 | C10 | H7 | 177.4° | 179.8° |
| C9 | C8 | C13 | H8 | 178.6° | 179.7° |
| C13 | C8 | C9 | C10 | 2.9° | 0.4° |
| C8 | C13 | C12 | H8 | 180.0° | 179.9° |
| C8 | C13 | C12 | C11 | 0.4° | 0.0° |
| C13 | C8 | C7 | H5 | 160.4° | 150.3° |
| C13 | C8 | C7 | H6 | 40.1° | 30.3° |
| C13 | C8 | C9 | H11 | 177.1° | 179.7° |
| C8 | C13 | C12 | H12 | 179.6° | 180.0° |
| C9 | C10 | C11 | H7 | 180.0° | 179.8° |
| C9 | C10 | C11 | C12 | 0.7° | 0.3° |
| C9 | C10 | C11 | F1 | 178.7° | 179.8° |
| C13 | C12 | C11 | C10 | 0.7° | 0.3° |
| C13 | C12 | C11 | H12 | 180.0° | 180.0° |
| C13 | C12 | C11 | F1 | 179.8° | 179.7° |
| C10 | C11 | C12 | F1 | 179.4° | 180.0° |
| C11 | C10 | C9 | H11 | 177.4° | 180.0° |
| C10 | C11 | C12 | H12 | 179.3° | 179.7° |
| C12 | C11 | C10 | H7 | 179.2° | 179.9° |
| C11 | C12 | C13 | H8 | 179.6° | 179.9° |
| F1 | C11 | C10 | H7 | 1.3° | 0.0° |
| F1 | C11 | C12 | H12 | 0.2° | 0.2° |
| C2 | C1 | C4 | H9 | 180.0° | 179.9° |
| C1 | C2 | C3 | H10 | 180.0° | 180.0° |
| C1 | C2 | C3 | C5 | 171.0° | 180.0° |
| C1 | C2 | C3 | O1 | 8.4° | 0.0° |
| C2 | C1 | C4 | O1 | 0.1° | 0.0° |
| C2 | C1 | C4 | H2 | 179.9° | 179.7° |
| C4 | C1 | C2 | C3 | 5.2° | 0.0° |
| C1 | C4 | O1 | C3 | 5.4° | 0.0° |
| C1 | C4 | O1 | H2 | 180.0° | 179.8° |
| C4 | C1 | C2 | H10 | 174.8° | 180.0° |
| C2 | C3 | C5 | N1 | 167.0° | 180.0° |
| C2 | C3 | C5 | O2 | 11.6° | 0.0° |
| C2 | C3 | C5 | O1 | 179.4° | 179.9° |
| C2 | C3 | O1 | C4 | 8.7° | 0.0° |
| C3 | C2 | C1 | H9 | 174.8° | 179.9° |
| C6 | N1 | C5 | H1 | 180.0° | 179.8° |
| C6 | N1 | C5 | O2 | 0.4° | 0.3° |
| C6 | N1 | C5 | C3 | 178.2° | 179.7° |
| N1 | C6 | H3 | H4 | 118.5° | 120.0° |
| N1 | C6 | C7 | H5 | 60.5° | 60.0° |
| N1 | C6 | C7 | H6 | 59.9° | 60.0° |
| N1 | C5 | O2 | C3 | 178.5° | 180.0° |
| N1 | C5 | C3 | O1 | 12.4° | 0.1° |
| C5 | N1 | C6 | H3 | 22.6° | 59.9° |
| C5 | N1 | C6 | H4 | 141.6° | 60.0° |
| O2 | C5 | C3 | O1 | 169.0° | 179.9° |
| O2 | C5 | N1 | H1 | 179.7° | 180.0° |
| C5 | C3 | O1 | C4 | 170.8° | 180.0° |
| C3 | C5 | N1 | H1 | 1.8° | 0.0° |
| C5 | C3 | C2 | H10 | 9.0° | 0.1° |
| C3 | O1 | C4 | H2 | 174.7° | 179.7° |
| O1 | C3 | C2 | H10 | 171.5° | 180.0° |
| O1 | C4 | C1 | H9 | 179.9° | 180.0° |
| H1 | N1 | C6 | H3 | 157.5° | 120.3° |
| H1 | N1 | C6 | H4 | 38.5° | 119.8° |
| H2 | C4 | C1 | H9 | 0.1° | 0.2° |
| H3 | C6 | C7 | H5 | 179.0° | 180.0° |
| H3 | C6 | C7 | H6 | 60.6° | 60.0° |
| H4 | C6 | C7 | H5 | 60.0° | 60.0° |
| H4 | C6 | C7 | H6 | 179.6° | 180.0° |
| H7 | C10 | C9 | H11 | 2.6° | 0.1° |
| H8 | C13 | C12 | H12 | 0.4° | 0.0° |
| H9 | C1 | C2 | H10 | 5.2° | 0.1° |
