L7W
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C16 | C15 | doub | 1.38Å | 1.40Å | Aromatic |
| C16 | C17 | sing | 1.38Å | 1.40Å | Aromatic |
| C15 | C14 | sing | 1.38Å | 1.40Å | Aromatic |
| C17 | C12 | doub | 1.39Å | 1.40Å | Aromatic |
| C14 | C13 | doub | 1.38Å | 1.40Å | Aromatic |
| C12 | C13 | sing | 1.39Å | 1.51Å | Aromatic |
| C12 | O1 | sing | 1.36Å | 1.38Å | |
| C13 | F | sing | 1.35Å | 1.36Å | |
| O1 | C11 | sing | 1.43Å | 1.44Å | |
| C11 | C10 | sing | 1.51Å | 1.53Å | |
| O2 | C10 | doub | 1.21Å | 1.23Å | |
| C10 | N2 | sing | 1.35Å | 1.37Å | |
| N2 | C9 | sing | 1.47Å | 1.46Å | |
| N2 | C8 | sing | 1.47Å | 1.46Å | |
| O | C5 | doub | 1.21Å | 1.23Å | |
| C9 | C6 | sing | 1.55Å | 1.52Å | |
| C8 | C7 | sing | 1.54Å | 1.52Å | |
| C5 | C6 | sing | 1.51Å | 1.50Å | |
| C5 | N1 | sing | 1.35Å | 1.35Å | |
| C | C1 | doub | 1.38Å | 1.40Å | Aromatic |
| C | C4 | sing | 1.39Å | 1.40Å | Aromatic |
| C6 | C7 | sing | 1.55Å | 1.51Å | |
| C1 | C2 | sing | 1.39Å | 1.38Å | Aromatic |
| N1 | C4 | sing | 1.39Å | 1.36Å | |
| C4 | N | doub | 1.32Å | 1.34Å | Aromatic |
| C2 | C3 | doub | 1.38Å | 1.38Å | Aromatic |
| N | C3 | sing | 1.32Å | 1.34Å | Aromatic |
| C11 | H1 | sing | 1.09Å | 1.10Å | |
| C11 | H2 | sing | 1.09Å | 1.10Å | |
| C17 | H3 | sing | 1.08Å | 1.08Å | |
| C16 | H4 | sing | 1.08Å | 1.08Å | |
| C15 | H5 | sing | 1.08Å | 1.08Å | |
| C14 | H6 | sing | 1.08Å | 1.08Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C7 | H9 | sing | 1.09Å | 1.10Å | |
| C7 | H10 | sing | 1.09Å | 1.10Å | |
| C9 | H11 | sing | 1.09Å | 1.10Å | |
| C9 | H12 | sing | 1.09Å | 1.10Å | |
| C6 | H13 | sing | 1.09Å | 1.10Å | |
| N1 | H14 | sing | 0.97Å | 1.00Å | |
| C | H15 | sing | 1.08Å | 1.08Å | |
| C3 | H16 | sing | 1.08Å | 1.08Å | |
| C2 | H17 | sing | 1.08Å | 1.08Å | |
| C1 | H18 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C15 | C16 | C17 | 120.7° | 120.1° |
| C16 | C15 | C14 | 121.0° | 120.2° |
| C15 | C16 | H4 | 119.6° | 120.0° |
| C16 | C15 | H5 | 119.5° | 120.0° |
| C16 | C17 | C12 | 120.7° | 120.0° |
| C16 | C17 | H3 | 119.7° | 120.0° |
| C17 | C16 | H4 | 119.7° | 119.9° |
| C15 | C14 | C13 | 121.4° | 120.0° |
| C14 | C15 | H5 | 119.5° | 119.9° |
| C15 | C14 | H6 | 119.3° | 120.0° |
| C17 | C12 | C13 | 118.9° | 119.9° |
| C17 | C12 | O1 | 119.3° | 120.1° |
| C12 | C17 | H3 | 119.7° | 120.0° |
| C14 | C13 | C12 | 117.5° | 119.9° |
| C14 | C13 | F | 119.1° | 120.0° |
| C13 | C14 | H6 | 119.3° | 120.0° |
| C13 | C12 | O1 | 121.8° | 120.0° |
| C12 | C13 | F | 123.4° | 120.1° |
| C12 | O1 | C11 | 125.6° | 117.0° |
| O1 | C11 | C10 | 112.2° | 109.5° |
| O1 | C11 | H1 | 108.8° | 109.5° |
| O1 | C11 | H2 | 108.8° | 109.4° |
| C11 | C10 | O2 | 115.5° | 120.0° |
| C11 | C10 | N2 | 121.0° | 120.0° |
| C10 | C11 | H1 | 108.8° | 109.5° |
| C10 | C11 | H2 | 108.8° | 109.5° |
| O2 | C10 | N2 | 123.5° | 120.0° |
| C10 | N2 | C9 | 126.1° | 125.7° |
| C10 | N2 | C8 | 124.8° | 125.6° |
| C9 | N2 | C8 | 109.2° | 108.7° |
| N2 | C9 | C6 | 104.4° | 105.0° |
| N2 | C9 | H11 | 110.7° | 110.4° |
| N2 | C9 | H12 | 110.7° | 110.4° |
| N2 | C8 | C7 | 103.2° | 107.3° |
| N2 | C8 | H7 | 111.0° | 109.9° |
| N2 | C8 | H8 | 111.0° | 109.9° |
| O | C5 | C6 | 119.7° | 120.0° |
| O | C5 | N1 | 127.0° | 119.9° |
| C9 | C6 | C5 | 112.5° | 111.0° |
| C9 | C6 | C7 | 106.0° | 101.7° |
| C6 | C9 | H11 | 110.7° | 110.4° |
| C6 | C9 | H12 | 110.7° | 110.3° |
| C9 | C6 | H13 | 109.7° | 111.0° |
| C8 | C7 | C6 | 107.2° | 103.0° |
| C7 | C8 | H7 | 111.0° | 109.9° |
| C7 | C8 | H8 | 111.0° | 109.8° |
| C8 | C7 | H9 | 110.0° | 110.7° |
| C8 | C7 | H10 | 110.0° | 110.7° |
| C6 | C5 | N1 | 113.3° | 120.0° |
| C5 | C6 | C7 | 108.7° | 111.2° |
| C5 | C6 | H13 | 110.0° | 110.9° |
| C5 | N1 | C4 | 126.8° | 120.1° |
| C5 | N1 | H14 | 116.6° | 119.9° |
| C1 | C | C4 | 120.9° | 119.1° |
| C | C1 | C2 | 119.0° | 118.5° |
| C1 | C | H15 | 119.5° | 120.4° |
| C | C1 | H18 | 120.5° | 120.8° |
| C | C4 | N1 | 125.8° | 119.7° |
| C | C4 | N | 117.8° | 120.6° |
| C4 | C | H15 | 119.6° | 120.4° |
| C6 | C7 | H9 | 110.1° | 110.7° |
| C6 | C7 | H10 | 110.0° | 110.9° |
| C7 | C6 | H13 | 109.9° | 110.7° |
| C1 | C2 | C3 | 118.3° | 119.3° |
| C1 | C2 | H17 | 120.8° | 120.4° |
| C2 | C1 | H18 | 120.5° | 120.7° |
| N1 | C4 | N | 116.3° | 119.6° |
| C4 | N1 | H14 | 116.6° | 120.0° |
| C4 | N | C3 | 122.1° | 121.6° |
| C2 | C3 | N | 121.9° | 120.9° |
| C2 | C3 | H16 | 119.1° | 119.6° |
| C3 | C2 | H17 | 120.8° | 120.3° |
| N | C3 | H16 | 119.0° | 119.5° |
| H1 | C11 | H2 | 109.5° | 109.5° |
| H7 | C8 | H8 | 109.5° | 110.1° |
| H9 | C7 | H10 | 109.4° | 110.6° |
| H11 | C9 | H12 | 109.5° | 110.3° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C15 | C16 | C17 | H4 | 180.0° | 179.9° |
| C16 | C15 | C14 | H5 | 180.0° | 180.0° |
| C15 | C16 | C17 | C12 | 0.4° | 0.0° |
| C16 | C15 | C14 | C13 | 0.0° | 0.1° |
| C15 | C16 | C17 | H3 | 179.6° | 180.0° |
| C16 | C15 | C14 | H6 | 179.9° | 180.0° |
| C17 | C16 | C15 | C14 | 0.0° | 0.0° |
| C16 | C17 | C12 | H3 | 180.0° | 180.0° |
| C16 | C17 | C12 | C13 | 0.8° | 0.0° |
| C16 | C17 | C12 | O1 | 179.4° | 179.7° |
| C17 | C16 | C15 | H5 | 180.0° | 180.0° |
| C15 | C14 | C13 | H6 | 180.0° | 179.9° |
| C15 | C14 | C13 | C12 | 0.4° | 0.1° |
| C15 | C14 | C13 | F | 180.0° | 179.7° |
| C14 | C15 | C16 | H4 | 180.0° | 179.9° |
| C17 | C12 | C13 | C14 | 0.8° | 0.1° |
| C17 | C12 | C13 | O1 | 178.5° | 179.7° |
| C17 | C12 | C13 | F | 179.6° | 179.7° |
| C17 | C12 | O1 | C11 | 55.9° | 0.3° |
| C12 | C17 | C16 | H4 | 179.6° | 179.9° |
| C14 | C13 | C12 | F | 179.6° | 179.8° |
| C14 | C13 | C12 | O1 | 179.4° | 179.7° |
| C13 | C14 | C15 | H5 | 180.0° | 180.0° |
| C13 | C12 | O1 | C11 | 125.6° | 180.0° |
| C13 | C12 | C17 | H3 | 179.2° | 180.0° |
| C12 | C13 | C14 | H6 | 179.5° | 180.0° |
| O1 | C12 | C13 | F | 1.1° | 0.1° |
| C12 | O1 | C11 | C10 | 80.3° | 180.0° |
| C12 | O1 | C11 | H1 | 40.2° | 60.0° |
| C12 | O1 | C11 | H2 | 159.4° | 60.0° |
| O1 | C12 | C17 | H3 | 0.6° | 0.3° |
| F | C13 | C14 | H6 | 0.0° | 0.2° |
| O1 | C11 | C10 | H1 | 120.4° | 120.0° |
| O1 | C11 | C10 | H2 | 120.4° | 120.0° |
| O1 | C11 | C10 | O2 | 90.9° | 0.0° |
| O1 | C11 | C10 | N2 | 91.0° | 179.7° |
| O1 | C11 | H1 | H2 | 118.8° | 120.0° |
| C11 | C10 | O2 | N2 | 178.1° | 179.7° |
| C11 | C10 | N2 | C9 | 26.0° | 179.7° |
| C11 | C10 | N2 | C8 | 153.5° | 0.0° |
| C10 | C11 | H1 | H2 | 118.7° | 120.0° |
| O2 | C10 | N2 | C9 | 156.0° | 0.0° |
| O2 | C10 | N2 | C8 | 24.5° | 179.7° |
| O2 | C10 | C11 | H1 | 29.5° | 120.0° |
| O2 | C10 | C11 | H2 | 148.7° | 120.0° |
| C10 | N2 | C9 | C8 | 179.6° | 179.8° |
| C10 | N2 | C9 | C6 | 150.2° | 155.9° |
| C10 | N2 | C8 | C7 | 148.0° | 178.9° |
| N2 | C10 | C11 | H1 | 148.6° | 59.7° |
| N2 | C10 | C11 | H2 | 29.4° | 60.3° |
| C10 | N2 | C8 | H7 | 29.0° | 61.7° |
| C10 | N2 | C8 | H8 | 93.0° | 59.5° |
| C10 | N2 | C9 | H11 | 90.6° | 36.9° |
| C10 | N2 | C9 | H12 | 31.0° | 85.3° |
| N2 | C9 | C6 | H11 | 119.2° | 118.9° |
| N2 | C9 | C6 | H12 | 119.2° | 118.9° |
| C9 | N2 | C8 | C7 | 32.4° | 0.9° |
| N2 | C9 | C6 | C5 | 103.3° | 155.1° |
| N2 | C9 | C6 | C7 | 15.3° | 36.7° |
| C9 | N2 | C8 | H7 | 151.4° | 118.5° |
| C9 | N2 | C8 | H8 | 86.6° | 120.2° |
| N2 | C9 | H11 | H12 | 122.4° | 122.2° |
| N2 | C9 | C6 | H13 | 133.9° | 81.1° |
| C8 | N2 | C9 | C6 | 30.3° | 23.8° |
| N2 | C8 | C7 | H7 | 119.0° | 119.4° |
| N2 | C8 | C7 | H8 | 119.0° | 119.4° |
| N2 | C8 | C7 | C6 | 21.4° | 22.1° |
| N2 | C8 | H7 | H8 | 122.9° | 121.1° |
| N2 | C8 | C7 | H9 | 98.3° | 96.2° |
| N2 | C8 | C7 | H10 | 141.1° | 140.7° |
| C8 | N2 | C9 | H11 | 88.9° | 142.8° |
| C8 | N2 | C9 | H12 | 149.4° | 95.0° |
| O | C5 | C6 | C9 | 24.0° | 118.5° |
| O | C5 | C6 | N1 | 179.7° | 180.0° |
| O | C5 | C6 | C7 | 93.0° | 6.1° |
| O | C5 | N1 | C4 | 4.2° | 5.0° |
| O | C5 | C6 | H13 | 146.7° | 117.6° |
| O | C5 | N1 | H14 | 175.8° | 175.0° |
| C9 | C6 | C7 | C8 | 3.9° | 35.3° |
| C9 | C6 | C5 | C7 | 117.0° | 112.5° |
| C9 | C6 | C5 | H13 | 122.6° | 123.9° |
| C9 | C6 | C5 | N1 | 156.3° | 61.4° |
| C9 | C6 | C7 | H13 | 118.5° | 117.9° |
| C9 | C6 | C7 | H9 | 115.8° | 83.1° |
| C9 | C6 | C7 | H10 | 123.5° | 153.8° |
| C6 | C9 | H11 | H12 | 122.3° | 122.1° |
| C8 | C7 | C6 | C5 | 125.0° | 153.5° |
| C8 | C7 | C6 | H9 | 119.7° | 118.3° |
| C8 | C7 | C6 | H10 | 119.7° | 118.5° |
| C7 | C8 | H7 | H8 | 122.9° | 121.1° |
| C8 | C7 | H9 | H10 | 121.0° | 123.1° |
| C8 | C7 | C6 | H13 | 114.7° | 82.7° |
| C5 | C6 | C7 | H13 | 120.4° | 123.8° |
| C6 | C5 | N1 | C4 | 176.1° | 174.9° |
| C5 | C6 | C7 | H9 | 5.3° | 35.2° |
| C5 | C6 | C7 | H10 | 115.4° | 88.0° |
| C5 | C6 | C9 | H11 | 137.5° | 86.0° |
| C5 | C6 | C9 | H12 | 15.9° | 36.2° |
| C6 | C5 | N1 | H14 | 3.9° | 5.1° |
| C5 | N1 | C4 | C | 3.7° | 174.9° |
| N1 | C5 | C6 | C7 | 86.7° | 173.9° |
| C5 | N1 | C4 | H14 | 180.0° | 180.0° |
| C5 | N1 | C4 | N | 175.4° | 4.7° |
| N1 | C5 | C6 | H13 | 33.6° | 62.4° |
| C1 | C | C4 | H15 | 180.0° | 180.0° |
| C | C1 | C2 | H18 | 180.0° | 180.0° |
| C1 | C | C4 | N1 | 179.3° | 180.0° |
| C1 | C | C4 | N | 0.2° | 0.3° |
| C | C1 | C2 | C3 | 0.6° | 0.2° |
| C | C1 | C2 | H17 | 179.4° | 180.0° |
| C4 | C | C1 | C2 | 0.6° | 0.0° |
| C | C4 | N1 | N | 179.1° | 179.7° |
| C | C4 | N | C3 | 0.2° | 0.3° |
| C | C4 | N1 | H14 | 176.3° | 5.1° |
| C4 | C | C1 | H18 | 179.4° | 180.0° |
| C6 | C7 | C8 | H7 | 140.4° | 141.6° |
| C6 | C7 | C8 | H8 | 97.6° | 97.3° |
| C6 | C7 | H9 | H10 | 121.1° | 123.3° |
| C7 | C6 | C9 | H11 | 103.9° | 155.6° |
| C7 | C6 | C9 | H12 | 134.5° | 82.2° |
| C1 | C2 | C3 | H17 | 180.0° | 179.8° |
| C1 | C2 | C3 | N | 0.2° | 0.2° |
| C2 | C1 | C | H15 | 179.4° | 179.9° |
| C1 | C2 | C3 | H16 | 179.8° | 179.7° |
| N1 | C4 | N | C3 | 179.0° | 180.0° |
| N1 | C4 | C | H15 | 0.7° | 0.0° |
| C4 | N | C3 | C2 | 0.2° | 0.1° |
| N | C4 | N1 | H14 | 4.6° | 175.2° |
| N | C4 | C | H15 | 179.8° | 179.7° |
| C4 | N | C3 | H16 | 179.8° | 180.0° |
| C2 | C3 | N | H16 | 180.0° | 179.9° |
| C3 | C2 | C1 | H18 | 179.4° | 179.8° |
| N | C3 | C2 | H17 | 179.9° | 180.0° |
| H3 | C17 | C16 | H4 | 0.4° | 0.0° |
| H4 | C16 | C15 | H5 | 0.0° | 0.0° |
| H5 | C15 | C14 | H6 | 0.1° | 0.1° |
| H7 | C8 | C7 | H9 | 20.7° | 23.2° |
| H7 | C8 | C7 | H10 | 99.9° | 99.9° |
| H8 | C8 | C7 | H9 | 142.7° | 144.4° |
| H8 | C8 | C7 | H10 | 22.1° | 21.3° |
| H9 | C7 | C6 | H13 | 125.7° | 159.0° |
| H10 | C7 | C6 | H13 | 5.0° | 35.8° |
| H11 | C9 | C6 | H13 | 14.7° | 37.9° |
| H12 | C9 | C6 | H13 | 106.9° | 160.1° |
| H15 | C | C1 | H18 | 0.6° | 0.1° |
| H16 | C3 | C2 | H17 | 0.1° | 0.1° |
| H17 | C2 | C1 | H18 | 0.5° | 0.0° |
