9F4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F26 | C23 | sing | 1.35Å | 1.34Å | |
| C23 | C22 | sing | 1.39Å | 1.37Å | Aromatic |
| C23 | C24 | doub | 1.39Å | 1.37Å | Aromatic |
| C22 | N21 | doub | 1.32Å | 1.35Å | Aromatic |
| N21 | C20 | sing | 1.33Å | 1.35Å | Aromatic |
| C24 | N25 | sing | 1.32Å | 1.35Å | Aromatic |
| N25 | C20 | doub | 1.33Å | 1.36Å | Aromatic |
| C20 | C12 | sing | 1.48Å | 1.47Å | |
| C12 | C11 | sing | 1.39Å | 1.40Å | Aromatic |
| C12 | C13 | doub | 1.39Å | 1.40Å | Aromatic |
| C11 | C10 | doub | 1.38Å | 1.40Å | Aromatic |
| C10 | C9 | sing | 1.38Å | 1.40Å | Aromatic |
| C13 | C14 | sing | 1.38Å | 1.39Å | Aromatic |
| C14 | C9 | doub | 1.38Å | 1.40Å | Aromatic |
| C9 | C8 | sing | 1.51Å | 1.50Å | |
| C8 | C15 | sing | 1.53Å | 1.51Å | |
| C8 | C7 | sing | 1.53Å | 1.52Å | |
| C15 | C16 | sing | 1.51Å | 1.47Å | |
| C15 | C7 | sing | 1.53Å | 1.51Å | |
| C16 | N18 | sing | 1.35Å | 1.36Å | |
| C16 | O17 | doub | 1.21Å | 1.23Å | |
| N18 | O19 | sing | 1.42Å | 1.40Å | |
| C7 | C6 | sing | 1.51Å | 1.51Å | |
| C6 | C1 | sing | 1.38Å | 1.40Å | Aromatic |
| C6 | C5 | doub | 1.38Å | 1.41Å | Aromatic |
| C1 | C2 | doub | 1.38Å | 1.40Å | Aromatic |
| C5 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
| C4 | C3 | doub | 1.38Å | 1.39Å | Aromatic |
| C3 | C2 | sing | 1.38Å | 1.39Å | Aromatic |
| O19 | H19 | sing | 0.97Å | 0.95Å | |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C24 | H24 | sing | 1.08Å | 1.08Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| N18 | H18 | sing | 0.97Å | 1.00Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F26 | C23 | C22 | 121.9° | 120.8° |
| F26 | C23 | C24 | 121.6° | 120.7° |
| C22 | C23 | C24 | 116.5° | 118.5° |
| C23 | C22 | N21 | 123.2° | 119.2° |
| C23 | C22 | H22 | 118.4° | 120.4° |
| C23 | C24 | N25 | 123.0° | 119.2° |
| C23 | C24 | H24 | 118.5° | 120.4° |
| C22 | N21 | C20 | 116.3° | 120.8° |
| N21 | C22 | H22 | 118.4° | 120.4° |
| N21 | C20 | N25 | 124.5° | 121.6° |
| N21 | C20 | C12 | 118.7° | 119.2° |
| C24 | N25 | C20 | 116.5° | 120.7° |
| N25 | C24 | H24 | 118.5° | 120.4° |
| N25 | C20 | C12 | 116.8° | 119.1° |
| C20 | C12 | C11 | 122.3° | 120.1° |
| C20 | C12 | C13 | 120.5° | 120.1° |
| C11 | C12 | C13 | 117.2° | 119.7° |
| C12 | C11 | C10 | 121.1° | 119.9° |
| C12 | C11 | H11 | 119.5° | 120.1° |
| C12 | C13 | C14 | 121.5° | 119.9° |
| C12 | C13 | H13 | 119.3° | 120.0° |
| C11 | C10 | C9 | 121.7° | 120.1° |
| C10 | C11 | H11 | 119.4° | 120.1° |
| C11 | C10 | H10 | 119.2° | 119.9° |
| C10 | C9 | C14 | 117.1° | 120.3° |
| C10 | C9 | C8 | 119.6° | 119.8° |
| C9 | C10 | H10 | 119.1° | 120.0° |
| C13 | C14 | C9 | 121.4° | 120.1° |
| C14 | C13 | H13 | 119.2° | 120.1° |
| C13 | C14 | H14 | 119.3° | 119.9° |
| C14 | C9 | C8 | 123.3° | 119.9° |
| C9 | C14 | H14 | 119.3° | 119.9° |
| C9 | C8 | C15 | 121.0° | 117.5° |
| C9 | C8 | C7 | 122.6° | 117.5° |
| C9 | C8 | H8 | 114.4° | 115.5° |
| C15 | C8 | C7 | 59.8° | 60.0° |
| C8 | C15 | C16 | 119.7° | 117.5° |
| C8 | C15 | C7 | 60.6° | 60.0° |
| C15 | C8 | H8 | 114.3° | 117.5° |
| C8 | C15 | H15 | 114.6° | 117.5° |
| C8 | C7 | C15 | 59.7° | 60.0° |
| C8 | C7 | C6 | 115.9° | 117.5° |
| C7 | C8 | H8 | 114.1° | 117.5° |
| C8 | C7 | H7 | 114.6° | 117.5° |
| C16 | C15 | C7 | 121.2° | 117.5° |
| C15 | C16 | N18 | 114.8° | 120.0° |
| C15 | C16 | O17 | 122.5° | 120.0° |
| C16 | C15 | H15 | 115.3° | 115.5° |
| C15 | C7 | C6 | 125.1° | 117.5° |
| C7 | C15 | H15 | 114.6° | 117.6° |
| C15 | C7 | H7 | 114.8° | 117.5° |
| N18 | C16 | O17 | 122.7° | 120.0° |
| C16 | N18 | O19 | 116.1° | 120.0° |
| C16 | N18 | H18 | 121.9° | 120.0° |
| N18 | O19 | H19 | 109.5° | 114.0° |
| O19 | N18 | H18 | 121.9° | 120.0° |
| C7 | C6 | C1 | 122.6° | 120.0° |
| C7 | C6 | C5 | 119.9° | 120.0° |
| C6 | C7 | H7 | 114.8° | 115.5° |
| C1 | C6 | C5 | 117.5° | 120.0° |
| C6 | C1 | C2 | 120.9° | 120.0° |
| C6 | C1 | H1 | 119.5° | 120.0° |
| C6 | C5 | C4 | 121.8° | 120.0° |
| C6 | C5 | H5 | 119.1° | 120.0° |
| C1 | C2 | C3 | 120.4° | 120.0° |
| C2 | C1 | H1 | 119.6° | 120.0° |
| C1 | C2 | H2 | 119.8° | 120.0° |
| C5 | C4 | C3 | 119.6° | 120.0° |
| C4 | C5 | H5 | 119.1° | 120.0° |
| C5 | C4 | H4 | 120.2° | 120.0° |
| C4 | C3 | C2 | 119.8° | 120.0° |
| C3 | C4 | H4 | 120.2° | 120.0° |
| C4 | C3 | H3 | 120.1° | 120.0° |
| C3 | C2 | H2 | 119.8° | 120.0° |
| C2 | C3 | H3 | 120.1° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F26 | C23 | C22 | C24 | 179.8° | 179.7° |
| F26 | C23 | C22 | N21 | 179.7° | 180.0° |
| F26 | C23 | C24 | N25 | 179.2° | 180.0° |
| F26 | C23 | C22 | H22 | 0.3° | 0.1° |
| F26 | C23 | C24 | H24 | 0.8° | 0.0° |
| C23 | C22 | N21 | H22 | 180.0° | 179.9° |
| C23 | C22 | N21 | C20 | 0.0° | 0.1° |
| C22 | C23 | C24 | N25 | 0.6° | 0.2° |
| C22 | C23 | C24 | H24 | 179.4° | 179.7° |
| C24 | C23 | C22 | N21 | 0.1° | 0.3° |
| C23 | C24 | N25 | H24 | 180.0° | 180.0° |
| C23 | C24 | N25 | C20 | 0.9° | 0.0° |
| C24 | C23 | C22 | H22 | 179.9° | 179.8° |
| C22 | N21 | C20 | N25 | 0.4° | 0.2° |
| C22 | N21 | C20 | C12 | 179.4° | 180.0° |
| N21 | C20 | N25 | C24 | 0.8° | 0.2° |
| N21 | C20 | N25 | C12 | 179.8° | 179.8° |
| N21 | C20 | C12 | C11 | 0.5° | 180.0° |
| N21 | C20 | C12 | C13 | 179.2° | 0.3° |
| C20 | N21 | C22 | H22 | 180.0° | 180.0° |
| C24 | N25 | C20 | C12 | 179.0° | 180.0° |
| N25 | C20 | C12 | C11 | 179.7° | 0.3° |
| N25 | C20 | C12 | C13 | 0.7° | 179.9° |
| C20 | N25 | C24 | H24 | 179.1° | 180.0° |
| C20 | C12 | C11 | C13 | 179.6° | 179.7° |
| C20 | C12 | C11 | C10 | 179.2° | 180.0° |
| C20 | C12 | C13 | C14 | 179.2° | 180.0° |
| C20 | C12 | C11 | H11 | 0.8° | 0.1° |
| C20 | C12 | C13 | H13 | 0.8° | 0.0° |
| C12 | C11 | C10 | H11 | 180.0° | 180.0° |
| C12 | C11 | C10 | C9 | 0.0° | 0.0° |
| C11 | C12 | C13 | C14 | 0.4° | 0.3° |
| C11 | C12 | C13 | H13 | 179.6° | 179.7° |
| C12 | C11 | C10 | H10 | 180.0° | 180.0° |
| C13 | C12 | C11 | C10 | 0.4° | 0.3° |
| C12 | C13 | C14 | H13 | 180.0° | 180.0° |
| C12 | C13 | C14 | C9 | 0.0° | 0.0° |
| C13 | C12 | C11 | H11 | 179.6° | 179.8° |
| C12 | C13 | C14 | H14 | 180.0° | 180.0° |
| C11 | C10 | C9 | H10 | 180.0° | 179.9° |
| C11 | C10 | C9 | C14 | 0.4° | 0.3° |
| C11 | C10 | C9 | C8 | 179.4° | 180.0° |
| C10 | C9 | C14 | C13 | 0.4° | 0.3° |
| C10 | C9 | C14 | C8 | 179.8° | 179.7° |
| C10 | C9 | C8 | C15 | 128.1° | 171.4° |
| C10 | C9 | C8 | C7 | 160.2° | 120.0° |
| C9 | C10 | C11 | H11 | 180.0° | 179.9° |
| C10 | C9 | C14 | H14 | 179.6° | 179.7° |
| C10 | C9 | C8 | H8 | 14.9° | 25.7° |
| C13 | C14 | C9 | H14 | 180.0° | 180.0° |
| C13 | C14 | C9 | C8 | 179.4° | 180.0° |
| C14 | C9 | C8 | C15 | 51.7° | 8.3° |
| C14 | C9 | C8 | C7 | 20.1° | 60.3° |
| C9 | C14 | C13 | H13 | 180.0° | 180.0° |
| C14 | C9 | C10 | H10 | 179.6° | 179.7° |
| C14 | C9 | C8 | H8 | 165.3° | 154.0° |
| C9 | C8 | C15 | C7 | 112.1° | 107.5° |
| C9 | C8 | C15 | H8 | 143.1° | 145.0° |
| C9 | C8 | C7 | H8 | 145.3° | 145.0° |
| C9 | C8 | C15 | C16 | 136.5° | 145.0° |
| C9 | C8 | C7 | C6 | 133.3° | 145.0° |
| C8 | C9 | C10 | H10 | 0.6° | 0.0° |
| C8 | C9 | C14 | H14 | 0.6° | 0.0° |
| C9 | C8 | C15 | H15 | 6.7° | 0.1° |
| C9 | C8 | C7 | H7 | 4.0° | 0.0° |
| C15 | C8 | C7 | H8 | 105.2° | 107.5° |
| C8 | C15 | C16 | C7 | 71.6° | 68.6° |
| C8 | C15 | C16 | H15 | 142.9° | 145.6° |
| C8 | C15 | C7 | H15 | 105.5° | 107.5° |
| C8 | C15 | C16 | N18 | 178.8° | 171.2° |
| C8 | C15 | C16 | O17 | 0.1° | 8.9° |
| C15 | C8 | C7 | C6 | 117.2° | 107.5° |
| C15 | C8 | C7 | H7 | 105.5° | 107.4° |
| C8 | C7 | C6 | H7 | 137.3° | 145.7° |
| C8 | C7 | C6 | C1 | 130.2° | 143.3° |
| C8 | C7 | C6 | C5 | 51.8° | 37.0° |
| C16 | C15 | C7 | H15 | 145.7° | 145.1° |
| C15 | C16 | N18 | O17 | 178.9° | 179.9° |
| C15 | C16 | N18 | O19 | 177.6° | 180.0° |
| C16 | C15 | C7 | C6 | 6.8° | 0.1° |
| C16 | C15 | C8 | H8 | 6.6° | 0.0° |
| C16 | C15 | C7 | H7 | 146.1° | 145.0° |
| C15 | C16 | N18 | H18 | 2.4° | 0.1° |
| C7 | C15 | C16 | N18 | 109.6° | 120.2° |
| C7 | C15 | C16 | O17 | 71.5° | 59.7° |
| C15 | C7 | C6 | H7 | 152.9° | 145.6° |
| C15 | C7 | C6 | C1 | 60.4° | 74.7° |
| C15 | C7 | C6 | C5 | 121.7° | 105.6° |
| C16 | N18 | O19 | H18 | 180.0° | 179.9° |
| C16 | N18 | O19 | H19 | 0.6° | 180.0° |
| N18 | C16 | C15 | H15 | 35.9° | 25.6° |
| O17 | C16 | N18 | O19 | 1.3° | 0.1° |
| O17 | C16 | C15 | H15 | 143.0° | 154.5° |
| O17 | C16 | N18 | H18 | 178.7° | 180.0° |
| C7 | C6 | C1 | C5 | 178.0° | 179.7° |
| C7 | C6 | C1 | C2 | 179.7° | 180.0° |
| C7 | C6 | C5 | C4 | 179.3° | 180.0° |
| C6 | C7 | C8 | H8 | 12.0° | 0.0° |
| C6 | C7 | C15 | H15 | 152.5° | 145.0° |
| C7 | C6 | C1 | H1 | 0.3° | 0.0° |
| C7 | C6 | C5 | H5 | 0.7° | 0.1° |
| C6 | C1 | C2 | H1 | 180.0° | 180.0° |
| C1 | C6 | C5 | C4 | 2.6° | 0.3° |
| C6 | C1 | C2 | C3 | 0.2° | 0.0° |
| C1 | C6 | C7 | H7 | 92.6° | 71.0° |
| C1 | C6 | C5 | H5 | 177.4° | 179.8° |
| C6 | C1 | C2 | H2 | 179.8° | 179.9° |
| C5 | C6 | C1 | C2 | 2.2° | 0.3° |
| C6 | C5 | C4 | H5 | 180.0° | 179.9° |
| C6 | C5 | C4 | C3 | 0.9° | 0.0° |
| C5 | C6 | C7 | H7 | 85.4° | 108.8° |
| C5 | C6 | C1 | H1 | 177.7° | 179.7° |
| C6 | C5 | C4 | H4 | 179.1° | 180.0° |
| C1 | C2 | C3 | C4 | 1.6° | 0.3° |
| C1 | C2 | C3 | H2 | 180.0° | 179.9° |
| C1 | C2 | C3 | H3 | 178.4° | 180.0° |
| C5 | C4 | C3 | H4 | 180.0° | 180.0° |
| C5 | C4 | C3 | C2 | 1.3° | 0.3° |
| C5 | C4 | C3 | H3 | 178.7° | 180.0° |
| C4 | C3 | C2 | H3 | 180.0° | 179.7° |
| C3 | C4 | C5 | H5 | 179.2° | 179.9° |
| C4 | C3 | C2 | H2 | 178.4° | 179.8° |
| C3 | C2 | C1 | H1 | 179.8° | 180.0° |
| C2 | C3 | C4 | H4 | 178.7° | 179.7° |
| H19 | O19 | N18 | H18 | 179.4° | 0.0° |
| H11 | C11 | C10 | H10 | 0.0° | 0.0° |
| H13 | C13 | C14 | H14 | 0.0° | 0.1° |
| H8 | C8 | C15 | H15 | 149.7° | 144.9° |
| H8 | C8 | C7 | H7 | 149.4° | 145.0° |
| H15 | C15 | C7 | H7 | 0.4° | 0.1° |
| H1 | C1 | C2 | H2 | 0.2° | 0.1° |
| H5 | C5 | C4 | H4 | 0.9° | 0.1° |
| H2 | C2 | C3 | H3 | 1.6° | 0.0° |
| H4 | C4 | C3 | H3 | 1.2° | 0.0° |
