24Y
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2 | C3 | doub | 1.39Å | 1.41Å | Aromatic |
| C2 | C1 | sing | 1.38Å | 1.40Å | Aromatic |
| C3 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
| C | C1 | sing | 1.51Å | 1.48Å | |
| C4 | N | doub | 1.32Å | 1.36Å | Aromatic |
| C1 | C5 | doub | 1.39Å | 1.43Å | Aromatic |
| C5 | N | sing | 1.32Å | 1.38Å | Aromatic |
| C5 | N1 | sing | 1.40Å | 1.44Å | |
| N1 | N4 | sing | 1.40Å | 1.34Å | Aromatic |
| N1 | C6 | sing | 1.36Å | 1.44Å | Aromatic |
| N2 | C11 | sing | 1.35Å | 1.34Å | |
| N2 | C10 | sing | 1.34Å | 1.44Å | |
| C11 | C7 | doub | 1.38Å | 1.45Å | |
| N4 | C12 | doub | 1.32Å | 1.33Å | Aromatic |
| O | C10 | doub | 1.22Å | 1.24Å | |
| C10 | C9 | sing | 1.41Å | 1.48Å | |
| C7 | C6 | sing | 1.48Å | 1.43Å | |
| C7 | C8 | sing | 1.41Å | 1.45Å | |
| C6 | N3 | doub | 1.32Å | 1.35Å | Aromatic |
| C12 | N3 | sing | 1.34Å | 1.42Å | Aromatic |
| C12 | C13 | sing | 1.48Å | 1.47Å | |
| C9 | C8 | doub | 1.36Å | 1.38Å | |
| C9 | CL | sing | 1.74Å | 1.68Å | |
| C14 | C13 | doub | 1.39Å | 1.41Å | Aromatic |
| C14 | C15 | sing | 1.38Å | 1.36Å | Aromatic |
| C13 | C18 | sing | 1.39Å | 1.36Å | Aromatic |
| C15 | C16 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | C17 | doub | 1.38Å | 1.42Å | Aromatic |
| C16 | C17 | sing | 1.38Å | 1.36Å | Aromatic |
| C8 | H1 | sing | 1.08Å | 1.08Å | |
| C11 | H2 | sing | 1.08Å | 1.08Å | |
| C18 | H4 | sing | 1.08Å | 1.08Å | |
| C17 | H5 | sing | 1.08Å | 1.08Å | |
| C16 | H6 | sing | 1.08Å | 1.08Å | |
| C15 | H7 | sing | 1.08Å | 1.08Å | |
| C14 | H8 | sing | 1.08Å | 1.08Å | |
| C | H9 | sing | 1.09Å | 1.10Å | |
| C | H10 | sing | 1.09Å | 1.10Å | |
| C | H11 | sing | 1.09Å | 1.10Å | |
| C4 | H12 | sing | 1.08Å | 1.08Å | |
| C3 | H13 | sing | 1.08Å | 1.08Å | |
| C2 | H14 | sing | 1.08Å | 1.08Å | |
| N2 | H15 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C3 | C2 | C1 | 120.0° | 118.5° |
| C2 | C3 | C4 | 120.4° | 119.3° |
| C2 | C3 | H13 | 119.8° | 120.3° |
| C3 | C2 | H14 | 120.0° | 120.8° |
| C2 | C1 | C | 118.8° | 120.4° |
| C2 | C1 | C5 | 115.7° | 119.1° |
| C1 | C2 | H14 | 120.0° | 120.8° |
| C3 | C4 | N | 122.0° | 120.8° |
| C3 | C4 | H12 | 119.0° | 119.6° |
| C4 | C3 | H13 | 119.8° | 120.3° |
| C | C1 | C5 | 125.4° | 120.4° |
| C1 | C | H9 | 109.5° | 109.4° |
| C1 | C | H10 | 109.5° | 109.5° |
| C1 | C | H11 | 109.4° | 109.5° |
| C4 | N | C5 | 117.2° | 121.7° |
| N | C4 | H12 | 119.0° | 119.6° |
| C1 | C5 | N | 124.6° | 120.6° |
| C1 | C5 | N1 | 125.2° | 119.7° |
| N | C5 | N1 | 110.2° | 119.7° |
| C5 | N1 | N4 | 120.8° | 126.9° |
| C5 | N1 | C6 | 129.2° | 126.8° |
| N4 | N1 | C6 | 109.9° | 106.3° |
| N1 | N4 | C12 | 106.6° | 107.0° |
| N1 | C6 | C7 | 126.9° | 126.1° |
| N1 | C6 | N3 | 106.4° | 107.8° |
| C11 | N2 | C10 | 122.5° | 121.0° |
| N2 | C11 | C7 | 122.0° | 120.4° |
| N2 | C11 | H2 | 119.0° | 119.8° |
| C11 | N2 | H15 | 118.7° | 119.5° |
| N2 | C10 | O | 118.4° | 119.8° |
| N2 | C10 | C9 | 114.5° | 120.4° |
| C10 | N2 | H15 | 118.7° | 119.5° |
| C11 | C7 | C6 | 122.6° | 120.2° |
| C11 | C7 | C8 | 119.3° | 119.5° |
| C7 | C11 | H2 | 119.0° | 119.8° |
| N4 | C12 | N3 | 111.2° | 109.1° |
| N4 | C12 | C13 | 123.4° | 125.4° |
| O | C10 | C9 | 127.0° | 119.8° |
| C10 | C9 | C8 | 124.6° | 119.5° |
| C10 | C9 | CL | 113.0° | 120.3° |
| C6 | C7 | C8 | 118.0° | 120.2° |
| C7 | C6 | N3 | 126.7° | 126.1° |
| C7 | C8 | C9 | 117.0° | 119.1° |
| C7 | C8 | H1 | 121.5° | 120.5° |
| C6 | N3 | C12 | 105.9° | 109.8° |
| N3 | C12 | C13 | 125.0° | 125.5° |
| C12 | C13 | C14 | 122.5° | 120.1° |
| C12 | C13 | C18 | 119.0° | 120.2° |
| C8 | C9 | CL | 122.4° | 120.3° |
| C9 | C8 | H1 | 121.5° | 120.5° |
| C13 | C14 | C15 | 119.2° | 119.9° |
| C14 | C13 | C18 | 118.4° | 119.7° |
| C13 | C14 | H8 | 120.4° | 120.0° |
| C14 | C15 | C16 | 122.5° | 120.1° |
| C14 | C15 | H7 | 118.7° | 120.0° |
| C15 | C14 | H8 | 120.4° | 120.1° |
| C13 | C18 | C17 | 121.7° | 119.9° |
| C13 | C18 | H4 | 119.2° | 120.0° |
| C15 | C16 | C17 | 119.1° | 120.2° |
| C15 | C16 | H6 | 120.5° | 119.9° |
| C16 | C15 | H7 | 118.7° | 119.9° |
| C18 | C17 | C16 | 118.9° | 120.1° |
| C17 | C18 | H4 | 119.2° | 120.1° |
| C18 | C17 | H5 | 120.5° | 120.0° |
| C16 | C17 | H5 | 120.5° | 119.9° |
| C17 | C16 | H6 | 120.4° | 119.9° |
| H9 | C | H10 | 109.5° | 109.5° |
| H9 | C | H11 | 109.5° | 109.5° |
| H10 | C | H11 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C3 | C2 | C1 | H14 | 180.0° | 179.2° |
| C2 | C3 | C4 | H13 | 180.0° | 179.6° |
| C3 | C2 | C1 | C | 175.7° | 179.5° |
| C2 | C3 | C4 | N | 0.1° | 0.5° |
| C3 | C2 | C1 | C5 | 1.4° | 0.5° |
| C2 | C3 | C4 | H12 | 179.9° | 179.5° |
| C1 | C2 | C3 | C4 | 1.0° | 0.7° |
| C2 | C1 | C | C5 | 176.8° | 180.0° |
| C2 | C1 | C5 | N | 0.8° | 0.0° |
| C2 | C1 | C5 | N1 | 178.1° | 179.7° |
| C2 | C1 | C | H9 | 91.4° | 95.3° |
| C2 | C1 | C | H10 | 148.6° | 24.7° |
| C2 | C1 | C | H11 | 28.6° | 144.7° |
| C1 | C2 | C3 | H13 | 179.0° | 179.7° |
| C3 | C4 | N | H12 | 180.0° | 179.9° |
| C3 | C4 | N | C5 | 0.8° | 0.1° |
| C4 | C3 | C2 | H14 | 179.0° | 179.9° |
| C | C1 | C5 | N | 176.0° | 180.0° |
| C | C1 | C5 | N1 | 5.1° | 0.3° |
| C1 | C | H9 | H10 | 120.0° | 120.0° |
| C1 | C | H9 | H11 | 120.0° | 120.0° |
| C1 | C | H10 | H11 | 120.0° | 120.0° |
| C | C1 | C2 | H14 | 4.4° | 0.3° |
| C4 | N | C5 | C1 | 0.3° | 0.3° |
| C4 | N | C5 | N1 | 179.3° | 180.0° |
| N | C4 | C3 | H13 | 179.8° | 180.0° |
| C1 | C5 | N | N1 | 179.0° | 179.7° |
| C1 | C5 | N1 | N4 | 95.1° | 46.6° |
| C1 | C5 | N1 | C6 | 82.2° | 132.9° |
| C5 | C1 | C | H9 | 91.8° | 84.7° |
| C5 | C1 | C | H10 | 28.2° | 155.3° |
| C5 | C1 | C | H11 | 148.2° | 35.3° |
| C5 | C1 | C2 | H14 | 178.6° | 179.7° |
| N | C5 | N1 | N4 | 83.9° | 133.1° |
| N | C5 | N1 | C6 | 98.8° | 47.4° |
| C5 | N | C4 | H12 | 179.2° | 180.0° |
| C5 | N1 | N4 | C6 | 177.8° | 179.5° |
| C5 | N1 | N4 | C12 | 176.0° | 180.0° |
| C5 | N1 | C6 | C7 | 5.8° | 0.3° |
| C5 | N1 | C6 | N3 | 174.8° | 180.0° |
| N4 | N1 | C6 | C7 | 176.6° | 179.8° |
| N4 | N1 | C6 | N3 | 2.8° | 0.4° |
| N1 | N4 | C12 | N3 | 0.2° | 0.3° |
| N1 | N4 | C12 | C13 | 173.7° | 179.6° |
| N1 | C6 | C7 | C11 | 19.5° | 125.3° |
| C6 | N1 | N4 | C12 | 1.8° | 0.4° |
| N1 | C6 | C7 | N3 | 179.3° | 179.7° |
| N1 | C6 | C7 | C8 | 155.9° | 55.2° |
| N1 | C6 | N3 | C12 | 2.5° | 0.3° |
| C11 | N2 | C10 | H15 | 180.0° | 179.7° |
| N2 | C11 | C7 | H2 | 180.0° | 179.7° |
| C11 | N2 | C10 | O | 179.6° | 180.0° |
| C11 | N2 | C10 | C9 | 1.6° | 0.1° |
| N2 | C11 | C7 | C6 | 173.6° | 180.0° |
| N2 | C11 | C7 | C8 | 1.8° | 0.5° |
| C10 | N2 | C11 | C7 | 2.4° | 0.3° |
| N2 | C10 | O | C9 | 177.7° | 179.9° |
| N2 | C10 | C9 | C8 | 0.3° | 0.1° |
| N2 | C10 | C9 | CL | 178.3° | 179.7° |
| C10 | N2 | C11 | H2 | 177.6° | 180.0° |
| C11 | C7 | C6 | C8 | 175.4° | 179.5° |
| C11 | C7 | C6 | N3 | 159.7° | 54.4° |
| C11 | C7 | C8 | C9 | 0.4° | 0.5° |
| C11 | C7 | C8 | H1 | 179.6° | 179.5° |
| C7 | C11 | N2 | H15 | 177.6° | 180.0° |
| N4 | C12 | N3 | C6 | 1.6° | 0.0° |
| N4 | C12 | N3 | C13 | 173.7° | 179.9° |
| N4 | C12 | C13 | C14 | 13.9° | 179.8° |
| N4 | C12 | C13 | C18 | 162.4° | 0.1° |
| O | C10 | C9 | C8 | 178.0° | 180.0° |
| O | C10 | C9 | CL | 0.5° | 0.2° |
| O | C10 | N2 | H15 | 0.5° | 0.3° |
| C10 | C9 | C8 | C7 | 0.3° | 0.2° |
| C10 | C9 | C8 | CL | 178.4° | 179.8° |
| C10 | C9 | C8 | H1 | 179.8° | 179.8° |
| C9 | C10 | N2 | H15 | 178.4° | 179.7° |
| C7 | C6 | N3 | C12 | 176.9° | 180.0° |
| C6 | C7 | C8 | C9 | 175.2° | 180.0° |
| C6 | C7 | C8 | H1 | 4.8° | 0.0° |
| C6 | C7 | C11 | H2 | 6.4° | 0.3° |
| C8 | C7 | C6 | N3 | 24.8° | 125.1° |
| C7 | C8 | C9 | H1 | 180.0° | 180.0° |
| C7 | C8 | C9 | CL | 178.6° | 180.0° |
| C8 | C7 | C11 | H2 | 178.2° | 179.7° |
| C6 | N3 | C12 | C13 | 175.3° | 179.9° |
| N3 | C12 | C13 | C14 | 173.1° | 0.3° |
| N3 | C12 | C13 | C18 | 10.7° | 180.0° |
| C12 | C13 | C14 | C18 | 176.3° | 179.7° |
| C12 | C13 | C14 | C15 | 179.0° | 179.8° |
| C12 | C13 | C18 | C17 | 179.7° | 180.0° |
| C12 | C13 | C18 | H4 | 0.4° | 0.1° |
| C12 | C13 | C14 | H8 | 1.0° | 0.1° |
| CL | C9 | C8 | H1 | 1.4° | 0.0° |
| C13 | C14 | C15 | H8 | 180.0° | 179.7° |
| C13 | C14 | C15 | C16 | 3.0° | 0.6° |
| C14 | C13 | C18 | C17 | 3.9° | 0.3° |
| C14 | C13 | C18 | H4 | 176.1° | 179.8° |
| C13 | C14 | C15 | H7 | 177.0° | 179.7° |
| C15 | C14 | C13 | C18 | 4.7° | 0.6° |
| C14 | C15 | C16 | H7 | 180.0° | 179.7° |
| C14 | C15 | C16 | C17 | 0.2° | 0.3° |
| C14 | C15 | C16 | H6 | 179.8° | 179.8° |
| C13 | C18 | C17 | H4 | 180.0° | 179.9° |
| C13 | C18 | C17 | C16 | 1.2° | 0.0° |
| C13 | C18 | C17 | H5 | 178.8° | 180.0° |
| C18 | C13 | C14 | H8 | 175.3° | 179.7° |
| C15 | C16 | C17 | C18 | 0.7° | 0.0° |
| C15 | C16 | C17 | H6 | 180.0° | 180.0° |
| C15 | C16 | C17 | H5 | 179.3° | 180.0° |
| C16 | C15 | C14 | H8 | 177.0° | 179.7° |
| C18 | C17 | C16 | H5 | 180.0° | 180.0° |
| C18 | C17 | C16 | H6 | 179.3° | 180.0° |
| C16 | C17 | C18 | H4 | 178.8° | 179.9° |
| C17 | C16 | C15 | H7 | 179.8° | 180.0° |
| H2 | C11 | N2 | H15 | 2.4° | 0.3° |
| H4 | C18 | C17 | H5 | 1.2° | 0.1° |
| H5 | C17 | C16 | H6 | 0.7° | 0.0° |
| H6 | C16 | C15 | H7 | 0.2° | 0.0° |
| H7 | C15 | C14 | H8 | 2.9° | 0.0° |
| H9 | C | H10 | H11 | 120.0° | 120.1° |
| H12 | C4 | C3 | H13 | 0.2° | 0.1° |
| H13 | C3 | C2 | H14 | 1.0° | 0.5° |
