F8Q
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C14 | O13 | sing | 1.43Å | 1.42Å | |
| C3 | C2 | doub | 1.38Å | 1.37Å | Aromatic |
| C3 | C4 | sing | 1.39Å | 1.37Å | Aromatic |
| O13 | C4 | sing | 1.36Å | 1.36Å | |
| C2 | C1 | sing | 1.38Å | 1.42Å | Aromatic |
| C4 | C5 | doub | 1.38Å | 1.42Å | Aromatic |
| C1 | C6 | doub | 1.39Å | 1.37Å | Aromatic |
| C5 | C6 | sing | 1.39Å | 1.38Å | Aromatic |
| C6 | C7 | sing | 1.48Å | 1.48Å | |
| C8 | C7 | doub | 1.39Å | 1.38Å | Aromatic |
| C8 | C9 | sing | 1.38Å | 1.40Å | Aromatic |
| C7 | C12 | sing | 1.40Å | 1.39Å | Aromatic |
| C9 | C10 | doub | 1.39Å | 1.38Å | Aromatic |
| C12 | F17 | sing | 1.35Å | 1.34Å | |
| C12 | C11 | doub | 1.38Å | 1.39Å | Aromatic |
| C23 | C24 | doub | 1.38Å | 1.39Å | Aromatic |
| C23 | C22 | sing | 1.38Å | 1.38Å | Aromatic |
| C25 | C22 | sing | 1.51Å | 1.54Å | |
| C25 | N26 | sing | 1.47Å | 1.50Å | |
| C24 | C19 | sing | 1.39Å | 1.39Å | Aromatic |
| C10 | C11 | sing | 1.39Å | 1.40Å | Aromatic |
| C10 | N18 | sing | 1.40Å | 1.36Å | |
| C22 | C21 | doub | 1.38Å | 1.40Å | Aromatic |
| C11 | O15 | sing | 1.36Å | 1.36Å | |
| C28 | N26 | sing | 1.47Å | 1.49Å | |
| N26 | C27 | sing | 1.47Å | 1.48Å | |
| C19 | N18 | sing | 1.40Å | 1.39Å | |
| C19 | C20 | doub | 1.39Å | 1.41Å | Aromatic |
| C21 | C20 | sing | 1.38Å | 1.42Å | Aromatic |
| O15 | C16 | sing | 1.43Å | 1.45Å | |
| C5 | H1 | sing | 1.08Å | 1.08Å | |
| C14 | H2 | sing | 1.09Å | 1.10Å | |
| C14 | H3 | sing | 1.09Å | 1.10Å | |
| C14 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.08Å | 1.08Å | |
| C2 | H6 | sing | 1.08Å | 1.08Å | |
| C1 | H7 | sing | 1.08Å | 1.08Å | |
| C16 | H8 | sing | 1.09Å | 1.10Å | |
| C16 | H9 | sing | 1.09Å | 1.10Å | |
| C16 | H10 | sing | 1.09Å | 1.10Å | |
| C9 | H11 | sing | 1.08Å | 1.08Å | |
| C8 | H12 | sing | 1.08Å | 1.08Å | |
| N18 | H13 | sing | 0.97Å | 1.00Å | |
| C24 | H14 | sing | 1.08Å | 1.08Å | |
| C23 | H15 | sing | 1.08Å | 1.08Å | |
| C21 | H16 | sing | 1.08Å | 1.08Å | |
| C20 | H17 | sing | 1.08Å | 1.08Å | |
| C25 | H18 | sing | 1.09Å | 1.10Å | |
| C25 | H19 | sing | 1.09Å | 1.10Å | |
| N26 | H20 | sing | 1.01Å | 1.00Å | |
| C28 | H21 | sing | 1.09Å | 1.10Å | |
| C28 | H22 | sing | 1.09Å | 1.10Å | |
| C28 | H23 | sing | 1.09Å | 1.10Å | |
| C27 | H24 | sing | 1.09Å | 1.10Å | |
| C27 | H25 | sing | 1.09Å | 1.10Å | |
| C27 | H26 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C14 | O13 | C4 | 123.1° | 117.0° |
| O13 | C14 | H2 | 109.5° | 109.4° |
| O13 | C14 | H3 | 109.5° | 109.5° |
| O13 | C14 | H4 | 109.5° | 109.4° |
| C2 | C3 | C4 | 117.0° | 120.2° |
| C3 | C2 | C1 | 120.6° | 120.2° |
| C2 | C3 | H5 | 121.5° | 119.9° |
| C3 | C2 | H6 | 119.7° | 120.0° |
| C3 | C4 | O13 | 115.4° | 120.0° |
| C3 | C4 | C5 | 122.1° | 120.1° |
| C4 | C3 | H5 | 121.5° | 119.9° |
| O13 | C4 | C5 | 122.5° | 120.0° |
| C2 | C1 | C6 | 122.8° | 120.0° |
| C1 | C2 | H6 | 119.7° | 119.9° |
| C2 | C1 | H7 | 118.6° | 120.0° |
| C4 | C5 | C6 | 121.3° | 119.8° |
| C4 | C5 | H1 | 119.4° | 120.1° |
| C1 | C6 | C5 | 116.1° | 119.8° |
| C1 | C6 | C7 | 121.9° | 120.1° |
| C6 | C1 | H7 | 118.6° | 120.0° |
| C5 | C6 | C7 | 121.9° | 120.1° |
| C6 | C5 | H1 | 119.3° | 120.1° |
| C6 | C7 | C8 | 116.9° | 120.1° |
| C6 | C7 | C12 | 126.1° | 120.0° |
| C7 | C8 | C9 | 120.9° | 120.0° |
| C8 | C7 | C12 | 116.9° | 119.9° |
| C7 | C8 | H12 | 119.5° | 119.9° |
| C8 | C9 | C10 | 123.0° | 120.2° |
| C8 | C9 | H11 | 118.5° | 119.9° |
| C9 | C8 | H12 | 119.5° | 120.1° |
| C7 | C12 | F17 | 121.5° | 120.0° |
| C7 | C12 | C11 | 121.2° | 119.9° |
| C9 | C10 | C11 | 115.0° | 120.1° |
| C9 | C10 | N18 | 125.7° | 120.0° |
| C10 | C9 | H11 | 118.5° | 119.9° |
| F17 | C12 | C11 | 117.3° | 120.1° |
| C12 | C11 | C10 | 122.9° | 120.0° |
| C12 | C11 | O15 | 114.3° | 120.0° |
| C24 | C23 | C22 | 122.5° | 120.1° |
| C23 | C24 | C19 | 123.2° | 119.9° |
| C23 | C24 | H14 | 118.4° | 120.0° |
| C24 | C23 | H15 | 118.8° | 119.9° |
| C23 | C22 | C25 | 117.3° | 119.9° |
| C23 | C22 | C21 | 116.1° | 120.1° |
| C22 | C23 | H15 | 118.7° | 120.0° |
| C22 | C25 | N26 | 117.7° | 109.5° |
| C25 | C22 | C21 | 126.6° | 119.9° |
| C22 | C25 | H18 | 107.3° | 109.5° |
| C22 | C25 | H19 | 107.4° | 109.5° |
| C25 | N26 | C28 | 113.9° | 109.4° |
| C25 | N26 | C27 | 113.3° | 109.5° |
| N26 | C25 | H18 | 107.4° | 109.5° |
| N26 | C25 | H19 | 107.4° | 109.5° |
| C25 | N26 | H20 | 106.4° | 109.5° |
| C24 | C19 | N18 | 121.2° | 120.1° |
| C24 | C19 | C20 | 114.5° | 119.8° |
| C19 | C24 | H14 | 118.4° | 120.1° |
| C11 | C10 | N18 | 119.2° | 119.9° |
| C10 | C11 | O15 | 122.9° | 120.0° |
| C10 | N18 | C19 | 126.2° | 119.9° |
| C10 | N18 | H13 | 116.9° | 120.0° |
| C22 | C21 | C20 | 121.2° | 120.1° |
| C22 | C21 | H16 | 119.4° | 119.9° |
| C11 | O15 | C16 | 123.8° | 117.0° |
| C28 | N26 | C27 | 109.8° | 109.4° |
| C28 | N26 | H20 | 106.5° | 109.5° |
| N26 | C28 | H21 | 109.5° | 109.5° |
| N26 | C28 | H22 | 109.5° | 109.5° |
| N26 | C28 | H23 | 109.5° | 109.5° |
| C27 | N26 | H20 | 106.5° | 109.5° |
| N26 | C27 | H24 | 109.5° | 109.4° |
| N26 | C27 | H25 | 109.5° | 109.5° |
| N26 | C27 | H26 | 109.5° | 109.5° |
| N18 | C19 | C20 | 123.8° | 120.1° |
| C19 | N18 | H13 | 116.9° | 120.0° |
| C19 | C20 | C21 | 122.4° | 120.0° |
| C19 | C20 | H17 | 118.8° | 120.0° |
| C20 | C21 | H16 | 119.4° | 120.1° |
| C21 | C20 | H17 | 118.8° | 120.0° |
| O15 | C16 | H8 | 109.5° | 109.5° |
| O15 | C16 | H9 | 109.5° | 109.5° |
| O15 | C16 | H10 | 109.5° | 109.5° |
| H2 | C14 | H3 | 109.5° | 109.5° |
| H2 | C14 | H4 | 109.5° | 109.4° |
| H3 | C14 | H4 | 109.5° | 109.5° |
| H8 | C16 | H9 | 109.5° | 109.4° |
| H8 | C16 | H10 | 109.4° | 109.4° |
| H9 | C16 | H10 | 109.4° | 109.5° |
| H18 | C25 | H19 | 109.5° | 109.5° |
| H21 | C28 | H22 | 109.5° | 109.4° |
| H21 | C28 | H23 | 109.5° | 109.5° |
| H22 | C28 | H23 | 109.5° | 109.4° |
| H24 | C27 | H25 | 109.5° | 109.5° |
| H24 | C27 | H26 | 109.5° | 109.5° |
| H25 | C27 | H26 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C14 | O13 | C4 | C3 | 138.4° | 0.0° |
| C14 | O13 | C4 | C5 | 43.2° | 180.0° |
| O13 | C14 | H2 | H3 | 120.0° | 120.1° |
| O13 | C14 | H2 | H4 | 120.0° | 119.9° |
| O13 | C14 | H3 | H4 | 120.0° | 120.0° |
| C2 | C3 | C4 | H5 | 180.0° | 179.8° |
| C2 | C3 | C4 | O13 | 179.3° | 180.0° |
| C3 | C2 | C1 | H6 | 180.0° | 179.8° |
| C2 | C3 | C4 | C5 | 0.8° | 0.0° |
| C3 | C2 | C1 | C6 | 1.3° | 0.5° |
| C3 | C2 | C1 | H7 | 178.7° | 180.0° |
| C3 | C4 | O13 | C5 | 178.5° | 180.0° |
| C4 | C3 | C2 | C1 | 0.1° | 0.2° |
| C3 | C4 | C5 | C6 | 0.2° | 0.0° |
| C3 | C4 | C5 | H1 | 179.8° | 180.0° |
| C4 | C3 | C2 | H6 | 179.9° | 180.0° |
| O13 | C4 | C5 | C6 | 178.6° | 180.0° |
| O13 | C4 | C5 | H1 | 1.4° | 0.0° |
| C4 | O13 | C14 | H2 | 180.0° | 180.0° |
| C4 | O13 | C14 | H3 | 60.0° | 60.0° |
| C4 | O13 | C14 | H4 | 60.0° | 60.1° |
| O13 | C4 | C3 | H5 | 0.7° | 0.2° |
| C2 | C1 | C6 | H7 | 180.0° | 179.5° |
| C2 | C1 | C6 | C5 | 1.8° | 0.5° |
| C2 | C1 | C6 | C7 | 178.1° | 179.8° |
| C1 | C2 | C3 | H5 | 179.9° | 180.0° |
| C4 | C5 | C6 | C1 | 1.1° | 0.3° |
| C4 | C5 | C6 | H1 | 180.0° | 180.0° |
| C4 | C5 | C6 | C7 | 177.4° | 180.0° |
| C5 | C4 | C3 | H5 | 179.2° | 179.8° |
| C1 | C6 | C5 | C7 | 176.3° | 179.7° |
| C1 | C6 | C7 | C8 | 63.8° | 129.8° |
| C1 | C6 | C7 | C12 | 117.8° | 50.3° |
| C1 | C6 | C5 | H1 | 178.9° | 179.8° |
| C6 | C1 | C2 | H6 | 178.7° | 179.8° |
| C5 | C6 | C7 | C8 | 112.3° | 49.9° |
| C5 | C6 | C7 | C12 | 66.1° | 130.0° |
| C5 | C6 | C1 | H7 | 178.2° | 180.0° |
| C6 | C7 | C8 | C12 | 178.5° | 179.9° |
| C6 | C7 | C8 | C9 | 178.5° | 179.9° |
| C6 | C7 | C12 | F17 | 1.3° | 0.0° |
| C6 | C7 | C12 | C11 | 178.5° | 179.7° |
| C7 | C6 | C5 | H1 | 2.6° | 0.0° |
| C7 | C6 | C1 | H7 | 1.9° | 0.3° |
| C6 | C7 | C8 | H12 | 1.4° | 0.1° |
| C7 | C8 | C9 | H12 | 180.0° | 180.0° |
| C7 | C8 | C9 | C10 | 1.2° | 0.3° |
| C8 | C7 | C12 | F17 | 179.6° | 180.0° |
| C8 | C7 | C12 | C11 | 0.2° | 0.3° |
| C7 | C8 | C9 | H11 | 178.8° | 180.0° |
| C9 | C8 | C7 | C12 | 0.1° | 0.0° |
| C8 | C9 | C10 | H11 | 180.0° | 179.7° |
| C8 | C9 | C10 | C11 | 2.1° | 0.2° |
| C8 | C9 | C10 | N18 | 179.1° | 179.8° |
| C7 | C12 | F17 | C11 | 179.8° | 179.7° |
| C7 | C12 | C11 | C10 | 0.9° | 0.3° |
| C7 | C12 | C11 | O15 | 179.8° | 179.8° |
| C12 | C7 | C8 | H12 | 179.9° | 179.9° |
| C9 | C10 | C11 | C12 | 2.0° | 0.0° |
| C9 | C10 | C11 | N18 | 177.2° | 180.0° |
| C9 | C10 | C11 | O15 | 179.2° | 180.0° |
| C9 | C10 | N18 | C19 | 12.2° | 7.8° |
| C10 | C9 | C8 | H12 | 178.9° | 179.8° |
| C9 | C10 | N18 | H13 | 167.9° | 172.3° |
| F17 | C12 | C11 | C10 | 179.3° | 180.0° |
| F17 | C12 | C11 | O15 | 0.4° | 0.1° |
| C12 | C11 | C10 | O15 | 178.8° | 179.9° |
| C12 | C11 | C10 | N18 | 179.2° | 179.9° |
| C12 | C11 | O15 | C16 | 53.0° | 90.0° |
| C24 | C23 | C22 | H15 | 180.0° | 180.0° |
| C24 | C23 | C22 | C25 | 179.4° | 180.0° |
| C23 | C24 | C19 | H14 | 180.0° | 180.0° |
| C24 | C23 | C22 | C21 | 0.6° | 0.0° |
| C23 | C24 | C19 | N18 | 172.4° | 180.0° |
| C23 | C24 | C19 | C20 | 0.4° | 0.3° |
| C23 | C22 | C25 | C21 | 180.0° | 180.0° |
| C23 | C22 | C25 | N26 | 136.7° | 90.0° |
| C22 | C23 | C24 | C19 | 0.4° | 0.0° |
| C23 | C22 | C21 | C20 | 0.8° | 0.3° |
| C22 | C23 | C24 | H14 | 179.6° | 180.0° |
| C23 | C22 | C21 | H16 | 179.2° | 180.0° |
| C23 | C22 | C25 | H18 | 102.1° | 150.0° |
| C23 | C22 | C25 | H19 | 15.5° | 30.0° |
| C22 | C25 | N26 | H18 | 121.2° | 120.0° |
| C22 | C25 | N26 | H19 | 121.2° | 120.0° |
| C22 | C25 | N26 | C28 | 165.4° | 65.0° |
| C22 | C25 | N26 | C27 | 39.0° | 175.0° |
| C25 | C22 | C21 | C20 | 179.2° | 179.7° |
| C25 | C22 | C23 | H15 | 0.6° | 0.0° |
| C25 | C22 | C21 | H16 | 0.8° | 0.0° |
| C22 | C25 | H18 | H19 | 116.2° | 120.0° |
| C22 | C25 | N26 | H20 | 77.6° | 55.0° |
| N26 | C25 | C22 | C21 | 43.3° | 90.0° |
| C25 | N26 | C28 | C27 | 128.2° | 120.0° |
| C25 | N26 | C28 | H20 | 116.9° | 120.0° |
| C25 | N26 | C27 | H20 | 116.6° | 120.0° |
| N26 | C25 | H18 | H19 | 116.3° | 120.0° |
| C25 | N26 | C28 | H21 | 180.0° | 60.0° |
| C25 | N26 | C28 | H22 | 60.0° | 180.0° |
| C25 | N26 | C28 | H23 | 60.0° | 60.1° |
| C25 | N26 | C27 | H24 | 180.0° | 60.0° |
| C25 | N26 | C27 | H25 | 60.0° | 180.0° |
| C25 | N26 | C27 | H26 | 60.0° | 59.9° |
| C24 | C19 | N18 | C10 | 44.7° | 42.0° |
| C24 | C19 | N18 | C20 | 172.1° | 179.7° |
| C24 | C19 | C20 | C21 | 0.6° | 0.7° |
| C24 | C19 | N18 | H13 | 135.4° | 137.8° |
| C19 | C24 | C23 | H15 | 179.6° | 180.0° |
| C24 | C19 | C20 | H17 | 179.4° | 179.7° |
| C11 | C10 | N18 | C19 | 164.7° | 172.2° |
| C10 | C11 | O15 | C16 | 128.2° | 90.0° |
| C11 | C10 | C9 | H11 | 177.9° | 180.0° |
| C11 | C10 | N18 | H13 | 15.3° | 7.7° |
| N18 | C10 | C11 | O15 | 2.0° | 0.0° |
| C10 | N18 | C19 | H13 | 180.0° | 179.9° |
| C10 | N18 | C19 | C20 | 127.5° | 138.3° |
| N18 | C10 | C9 | H11 | 0.9° | 0.1° |
| C22 | C21 | C20 | C19 | 0.9° | 0.6° |
| C22 | C21 | C20 | H16 | 180.0° | 179.7° |
| C21 | C22 | C23 | H15 | 179.4° | 180.0° |
| C22 | C21 | C20 | H17 | 179.1° | 179.7° |
| C21 | C22 | C25 | H18 | 77.9° | 30.0° |
| C21 | C22 | C25 | H19 | 164.5° | 150.0° |
| C11 | O15 | C16 | H8 | 180.0° | 60.0° |
| C11 | O15 | C16 | H9 | 60.0° | 60.0° |
| C11 | O15 | C16 | H10 | 60.0° | 180.0° |
| C28 | N26 | C27 | H20 | 114.9° | 120.0° |
| C28 | N26 | C25 | H18 | 73.4° | 55.0° |
| C28 | N26 | C25 | H19 | 44.3° | 175.0° |
| N26 | C28 | H21 | H22 | 120.0° | 120.0° |
| N26 | C28 | H21 | H23 | 120.0° | 120.1° |
| N26 | C28 | H22 | H23 | 120.0° | 120.0° |
| C28 | N26 | C27 | H24 | 51.5° | 180.0° |
| C28 | N26 | C27 | H25 | 68.5° | 60.1° |
| C28 | N26 | C27 | H26 | 171.5° | 60.0° |
| C27 | N26 | C25 | H18 | 160.2° | 65.0° |
| C27 | N26 | C25 | H19 | 82.1° | 55.0° |
| C27 | N26 | C28 | H21 | 51.9° | 59.9° |
| C27 | N26 | C28 | H22 | 171.9° | 60.0° |
| C27 | N26 | C28 | H23 | 68.2° | 180.0° |
| N26 | C27 | H24 | H25 | 120.0° | 119.9° |
| N26 | C27 | H24 | H26 | 120.0° | 120.0° |
| N26 | C27 | H25 | H26 | 120.0° | 120.0° |
| N18 | C19 | C20 | C21 | 172.0° | 179.7° |
| N18 | C19 | C24 | H14 | 7.5° | 0.0° |
| N18 | C19 | C20 | H17 | 8.0° | 0.0° |
| C19 | C20 | C21 | H17 | 180.0° | 179.7° |
| C20 | C19 | N18 | H13 | 52.5° | 41.8° |
| C20 | C19 | C24 | H14 | 179.7° | 179.7° |
| C19 | C20 | C21 | H16 | 179.2° | 179.7° |
| O15 | C16 | H8 | H9 | 120.0° | 120.0° |
| O15 | C16 | H8 | H10 | 120.0° | 120.0° |
| O15 | C16 | H9 | H10 | 120.0° | 120.0° |
| H2 | C14 | H3 | H4 | 120.0° | 120.0° |
| H5 | C3 | C2 | H6 | 0.1° | 0.2° |
| H6 | C2 | C1 | H7 | 1.3° | 0.2° |
| H8 | C16 | H9 | H10 | 120.0° | 120.0° |
| H11 | C9 | C8 | H12 | 1.1° | 0.1° |
| H14 | C24 | C23 | H15 | 0.4° | 0.0° |
| H16 | C21 | C20 | H17 | 0.9° | 0.0° |
| H18 | C25 | N26 | H20 | 43.5° | 175.0° |
| H19 | C25 | N26 | H20 | 161.2° | 65.0° |
| H20 | N26 | C28 | H21 | 63.1° | 180.0° |
| H20 | N26 | C28 | H22 | 56.9° | 60.0° |
| H20 | N26 | C28 | H23 | 176.9° | 59.9° |
| H20 | N26 | C27 | H24 | 63.4° | 60.0° |
| H20 | N26 | C27 | H25 | 176.6° | 59.9° |
| H20 | N26 | C27 | H26 | 56.6° | 180.0° |
| H21 | C28 | H22 | H23 | 120.0° | 120.0° |
| H24 | C27 | H25 | H26 | 120.0° | 120.1° |
