9F6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C13 | C14 | doub | 1.38Å | 1.39Å | Aromatic |
| C13 | C11 | sing | 1.38Å | 1.38Å | Aromatic |
| C14 | N1 | sing | 1.32Å | 1.37Å | Aromatic |
| C11 | C5 | doub | 1.40Å | 1.39Å | Aromatic |
| N1 | C12 | doub | 1.32Å | 1.37Å | Aromatic |
| C5 | C12 | sing | 1.40Å | 1.40Å | Aromatic |
| C5 | C7 | sing | 1.47Å | 1.48Å | |
| C7 | C6 | doub | 1.35Å | 1.48Å | |
| C9 | C4 | doub | 1.38Å | 1.40Å | Aromatic |
| C9 | C10 | sing | 1.39Å | 1.39Å | Aromatic |
| C4 | C1 | sing | 1.40Å | 1.41Å | Aromatic |
| C6 | C3 | sing | 1.46Å | 1.48Å | |
| C10 | C8 | doub | 1.38Å | 1.39Å | Aromatic |
| C1 | C3 | sing | 1.48Å | 1.52Å | |
| C1 | C2 | doub | 1.40Å | 1.40Å | Aromatic |
| C3 | O2 | doub | 1.22Å | 1.28Å | |
| C8 | C2 | sing | 1.39Å | 1.40Å | Aromatic |
| C2 | O1 | sing | 1.36Å | 1.36Å | |
| O1 | H1 | sing | 0.97Å | 0.95Å | |
| C8 | H2 | sing | 1.08Å | 1.08Å | |
| C10 | H3 | sing | 1.08Å | 1.08Å | |
| C9 | H4 | sing | 1.08Å | 1.08Å | |
| C4 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C12 | H8 | sing | 1.08Å | 1.08Å | |
| C14 | H9 | sing | 1.08Å | 1.08Å | |
| C13 | H10 | sing | 1.08Å | 1.08Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C14 | C13 | C11 | 121.3° | 119.4° |
| C13 | C14 | N1 | 119.3° | 121.1° |
| C13 | C14 | H9 | 120.4° | 119.4° |
| C14 | C13 | H10 | 119.3° | 120.3° |
| C13 | C11 | C5 | 118.2° | 118.3° |
| C11 | C13 | H10 | 119.4° | 120.3° |
| C13 | C11 | H11 | 120.9° | 120.9° |
| C14 | N1 | C12 | 121.3° | 121.9° |
| N1 | C14 | H9 | 120.4° | 119.5° |
| C11 | C5 | C12 | 120.6° | 118.8° |
| C11 | C5 | C7 | 117.7° | 120.6° |
| C5 | C11 | H11 | 120.9° | 120.8° |
| N1 | C12 | C5 | 119.3° | 120.5° |
| N1 | C12 | H8 | 120.4° | 119.7° |
| C12 | C5 | C7 | 121.7° | 120.5° |
| C5 | C12 | H8 | 120.3° | 119.8° |
| C5 | C7 | C6 | 127.4° | 120.0° |
| C5 | C7 | H7 | 116.3° | 120.0° |
| C7 | C6 | C3 | 121.6° | 120.0° |
| C7 | C6 | H6 | 119.2° | 120.0° |
| C6 | C7 | H7 | 116.3° | 120.0° |
| C4 | C9 | C10 | 120.3° | 120.3° |
| C9 | C4 | C1 | 120.4° | 119.9° |
| C4 | C9 | H4 | 119.9° | 119.9° |
| C9 | C4 | H5 | 119.8° | 120.0° |
| C9 | C10 | C8 | 120.0° | 120.4° |
| C9 | C10 | H3 | 120.0° | 119.8° |
| C10 | C9 | H4 | 119.9° | 119.9° |
| C4 | C1 | C3 | 120.1° | 120.2° |
| C4 | C1 | C2 | 118.1° | 119.6° |
| C1 | C4 | H5 | 119.8° | 120.1° |
| C6 | C3 | C1 | 115.5° | 120.0° |
| C6 | C3 | O2 | 118.0° | 120.1° |
| C3 | C6 | H6 | 119.2° | 120.0° |
| C10 | C8 | C2 | 119.9° | 120.1° |
| C10 | C8 | H2 | 120.0° | 120.0° |
| C8 | C10 | H3 | 120.0° | 119.8° |
| C3 | C1 | C2 | 121.7° | 120.2° |
| C1 | C3 | O2 | 126.4° | 119.9° |
| C1 | C2 | C8 | 121.3° | 119.7° |
| C1 | C2 | O1 | 120.8° | 120.1° |
| C8 | C2 | O1 | 117.8° | 120.2° |
| C2 | C8 | H2 | 120.0° | 119.9° |
| C2 | O1 | H1 | 109.5° | 114.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C14 | C13 | C11 | H10 | 180.0° | 179.7° |
| C13 | C14 | N1 | H9 | 180.0° | 180.0° |
| C14 | C13 | C11 | C5 | 0.1° | 0.5° |
| C13 | C14 | N1 | C12 | 2.4° | 0.0° |
| C14 | C13 | C11 | H11 | 179.9° | 180.0° |
| C11 | C13 | C14 | N1 | 1.9° | 0.3° |
| C13 | C11 | C5 | H11 | 180.0° | 179.5° |
| C13 | C11 | C5 | C12 | 1.2° | 0.5° |
| C13 | C11 | C5 | C7 | 179.1° | 179.7° |
| C11 | C13 | C14 | H9 | 178.2° | 179.7° |
| C14 | N1 | C12 | C5 | 1.1° | 0.0° |
| C14 | N1 | C12 | H8 | 178.9° | 180.0° |
| N1 | C14 | C13 | H10 | 178.1° | 180.0° |
| C11 | C5 | C12 | N1 | 0.7° | 0.3° |
| C11 | C5 | C12 | C7 | 179.7° | 179.7° |
| C11 | C5 | C7 | C6 | 179.8° | 179.7° |
| C11 | C5 | C7 | H7 | 0.2° | 0.3° |
| C11 | C5 | C12 | H8 | 179.3° | 179.7° |
| C5 | C11 | C13 | H10 | 179.9° | 179.7° |
| N1 | C12 | C5 | H8 | 180.0° | 180.0° |
| N1 | C12 | C5 | C7 | 179.6° | 180.0° |
| C12 | N1 | C14 | H9 | 177.6° | 179.9° |
| C12 | C5 | C7 | C6 | 0.1° | 0.0° |
| C12 | C5 | C7 | H7 | 179.9° | 180.0° |
| C12 | C5 | C11 | H11 | 178.8° | 179.9° |
| C5 | C7 | C6 | H7 | 180.0° | 180.0° |
| C5 | C7 | C6 | C3 | 163.0° | 180.0° |
| C5 | C7 | C6 | H6 | 17.0° | 0.0° |
| C7 | C5 | C12 | H8 | 0.4° | 0.0° |
| C7 | C5 | C11 | H11 | 0.9° | 0.2° |
| C7 | C6 | C3 | H6 | 180.0° | 180.0° |
| C7 | C6 | C3 | C1 | 54.7° | 180.0° |
| C7 | C6 | C3 | O2 | 121.8° | 0.0° |
| C4 | C9 | C10 | H4 | 180.0° | 179.7° |
| C9 | C4 | C1 | H5 | 180.0° | 179.7° |
| C4 | C9 | C10 | C8 | 2.0° | 0.0° |
| C9 | C4 | C1 | C3 | 177.7° | 180.0° |
| C9 | C4 | C1 | C2 | 0.2° | 0.5° |
| C4 | C9 | C10 | H3 | 178.0° | 180.0° |
| C10 | C9 | C4 | C1 | 1.5° | 0.3° |
| C9 | C10 | C8 | H3 | 180.0° | 180.0° |
| C9 | C10 | C8 | C2 | 1.2° | 0.0° |
| C9 | C10 | C8 | H2 | 178.8° | 180.0° |
| C10 | C9 | C4 | H5 | 178.5° | 180.0° |
| C4 | C1 | C3 | C6 | 23.9° | 0.0° |
| C4 | C1 | C3 | C2 | 177.8° | 179.5° |
| C4 | C1 | C3 | O2 | 160.1° | 180.0° |
| C4 | C1 | C2 | C8 | 0.6° | 0.5° |
| C4 | C1 | C2 | O1 | 176.9° | 179.7° |
| C1 | C4 | C9 | H4 | 178.5° | 179.9° |
| C6 | C3 | C1 | O2 | 176.1° | 180.0° |
| C6 | C3 | C1 | C2 | 158.3° | 179.5° |
| C3 | C6 | C7 | H7 | 17.0° | 0.0° |
| C10 | C8 | C2 | C1 | 0.1° | 0.2° |
| C10 | C8 | C2 | H2 | 180.0° | 180.0° |
| C10 | C8 | C2 | O1 | 176.5° | 180.0° |
| C8 | C10 | C9 | H4 | 178.0° | 179.7° |
| C3 | C1 | C2 | C8 | 178.5° | 180.0° |
| C3 | C1 | C2 | O1 | 5.2° | 0.2° |
| C3 | C1 | C4 | H5 | 2.3° | 0.2° |
| C1 | C3 | C6 | H6 | 125.4° | 0.0° |
| C2 | C1 | C3 | O2 | 17.7° | 0.5° |
| C1 | C2 | C8 | O1 | 176.4° | 179.8° |
| C1 | C2 | O1 | H1 | 11.0° | 90.2° |
| C1 | C2 | C8 | H2 | 179.9° | 179.8° |
| C2 | C1 | C4 | H5 | 179.8° | 179.8° |
| O2 | C3 | C6 | H6 | 58.2° | 180.0° |
| C8 | C2 | O1 | H1 | 172.6° | 90.0° |
| C2 | C8 | C10 | H3 | 178.8° | 180.0° |
| O1 | C2 | C8 | H2 | 3.5° | 0.0° |
| H2 | C8 | C10 | H3 | 1.2° | 0.0° |
| H3 | C10 | C9 | H4 | 2.0° | 0.3° |
| H4 | C9 | C4 | H5 | 1.5° | 0.3° |
| H6 | C6 | C7 | H7 | 163.0° | 180.0° |
| H9 | C14 | C13 | H10 | 1.9° | 0.1° |
| H10 | C13 | C11 | H11 | 0.1° | 0.2° |
