C7Y
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C18 | C17 | doub | 1.38Å | 1.38Å | Aromatic |
| C18 | C19 | sing | 1.40Å | 1.40Å | Aromatic |
| N27 | C22 | doub | 1.31Å | 1.31Å | Aromatic |
| N27 | N25 | sing | 1.40Å | 1.40Å | Aromatic |
| N21 | C19 | sing | 1.39Å | 1.39Å | |
| N21 | C22 | sing | 1.40Å | 1.41Å | |
| C17 | N16 | sing | 1.32Å | 1.33Å | Aromatic |
| C19 | N20 | doub | 1.33Å | 1.33Å | Aromatic |
| C22 | C23 | sing | 1.40Å | 1.42Å | Aromatic |
| N25 | C24 | sing | 1.35Å | 1.35Å | Aromatic |
| N16 | C15 | doub | 1.32Å | 1.33Å | Aromatic |
| N20 | C15 | sing | 1.32Å | 1.33Å | Aromatic |
| C23 | C24 | doub | 1.35Å | 1.36Å | Aromatic |
| C24 | C28 | sing | 1.51Å | 1.51Å | |
| C15 | N14 | sing | 1.38Å | 1.38Å | |
| C28 | C30 | sing | 1.53Å | 1.53Å | |
| C28 | C29 | sing | 1.53Å | 1.53Å | |
| N14 | C2 | sing | 1.47Å | 1.46Å | |
| C30 | C29 | sing | 1.53Å | 1.53Å | |
| C2 | C4 | sing | 1.51Å | 1.51Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| C5 | C6 | doub | 1.38Å | 1.39Å | Aromatic |
| C5 | C4 | sing | 1.39Å | 1.39Å | Aromatic |
| C6 | C7 | sing | 1.39Å | 1.39Å | Aromatic |
| C4 | N9 | doub | 1.31Å | 1.32Å | Aromatic |
| N9 | C8 | sing | 1.33Å | 1.33Å | Aromatic |
| C7 | C8 | doub | 1.41Å | 1.41Å | Aromatic |
| C7 | N12 | sing | 1.38Å | 1.38Å | Aromatic |
| C8 | C10 | sing | 1.46Å | 1.46Å | Aromatic |
| N12 | C11 | sing | 1.37Å | 1.36Å | Aromatic |
| C10 | C11 | doub | 1.34Å | 1.34Å | Aromatic |
| C5 | H1 | sing | 1.08Å | 1.08Å | |
| C6 | H2 | sing | 1.08Å | 1.08Å | |
| C10 | H3 | sing | 1.08Å | 1.08Å | |
| N12 | H4 | sing | 0.97Å | 1.00Å | |
| C17 | H5 | sing | 1.08Å | 1.08Å | |
| C28 | H6 | sing | 1.09Å | 1.10Å | |
| C1 | H7 | sing | 1.09Å | 1.10Å | |
| C1 | H8 | sing | 1.09Å | 1.10Å | |
| C1 | H9 | sing | 1.09Å | 1.10Å | |
| C2 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| N14 | H12 | sing | 0.97Å | 1.00Å | |
| C18 | H13 | sing | 1.08Å | 1.08Å | |
| N21 | H14 | sing | 0.97Å | 1.00Å | |
| C23 | H15 | sing | 1.08Å | 1.08Å | |
| N25 | H16 | sing | 0.97Å | 1.00Å | |
| C29 | H17 | sing | 1.09Å | 1.10Å | |
| C29 | H18 | sing | 1.09Å | 1.10Å | |
| C30 | H19 | sing | 1.09Å | 1.10Å | |
| C30 | H20 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C17 | C18 | C19 | 119.0° | 118.5° |
| C18 | C17 | N16 | 119.0° | 119.3° |
| C18 | C17 | H5 | 120.5° | 120.3° |
| C17 | C18 | H13 | 120.5° | 120.8° |
| C18 | C19 | N21 | 119.3° | 120.5° |
| C18 | C19 | N20 | 118.4° | 119.0° |
| C19 | C18 | H13 | 120.5° | 120.7° |
| C22 | N27 | N25 | 108.6° | 108.2° |
| N27 | C22 | N21 | 122.5° | 126.0° |
| N27 | C22 | C23 | 107.4° | 108.1° |
| N27 | N25 | C24 | 108.6° | 108.0° |
| N27 | N25 | H16 | 125.7° | 126.0° |
| C19 | N21 | C22 | 126.7° | 120.0° |
| N21 | C19 | N20 | 122.3° | 120.5° |
| C19 | N21 | H14 | 116.6° | 120.0° |
| N21 | C22 | C23 | 130.2° | 125.9° |
| C22 | N21 | H14 | 116.6° | 120.0° |
| C17 | N16 | C15 | 120.9° | 120.9° |
| N16 | C17 | H5 | 120.5° | 120.3° |
| C19 | N20 | C15 | 121.0° | 120.6° |
| C22 | C23 | C24 | 108.0° | 107.8° |
| C22 | C23 | H15 | 126.0° | 126.1° |
| N25 | C24 | C23 | 107.4° | 107.9° |
| N25 | C24 | C28 | 123.9° | 126.0° |
| C24 | N25 | H16 | 125.7° | 126.0° |
| N16 | C15 | N20 | 121.7° | 121.7° |
| N16 | C15 | N14 | 119.5° | 119.2° |
| N20 | C15 | N14 | 118.8° | 119.1° |
| C23 | C24 | C28 | 128.8° | 126.1° |
| C24 | C23 | H15 | 126.0° | 126.0° |
| C24 | C28 | C30 | 117.6° | 117.6° |
| C24 | C28 | C29 | 119.8° | 117.5° |
| C24 | C28 | H6 | 116.1° | 115.5° |
| C15 | N14 | C2 | 119.4° | 119.9° |
| C15 | N14 | H12 | 106.9° | 120.0° |
| C30 | C28 | C29 | 59.9° | 60.0° |
| C28 | C30 | C29 | 60.1° | 60.0° |
| C30 | C28 | H6 | 115.8° | 117.5° |
| C28 | C30 | H19 | 120.0° | 117.4° |
| C28 | C30 | H20 | 120.0° | 117.5° |
| C28 | C29 | C30 | 60.0° | 60.0° |
| C29 | C28 | H6 | 115.8° | 117.5° |
| C28 | C29 | H17 | 120.0° | 117.6° |
| C28 | C29 | H18 | 120.0° | 117.5° |
| N14 | C2 | C4 | 111.6° | 109.4° |
| N14 | C2 | C1 | 108.9° | 109.5° |
| N14 | C2 | H10 | 110.0° | 109.5° |
| C2 | N14 | H12 | 106.9° | 120.0° |
| C30 | C29 | H17 | 120.0° | 117.5° |
| C30 | C29 | H18 | 120.0° | 117.5° |
| C29 | C30 | H19 | 120.0° | 117.5° |
| C29 | C30 | H20 | 120.0° | 117.5° |
| C4 | C2 | C1 | 108.0° | 109.4° |
| C2 | C4 | C5 | 120.6° | 119.3° |
| C2 | C4 | N9 | 118.4° | 119.4° |
| C4 | C2 | H10 | 109.3° | 109.4° |
| C2 | C1 | H7 | 109.5° | 109.5° |
| C2 | C1 | H8 | 109.5° | 109.4° |
| C2 | C1 | H9 | 109.4° | 109.5° |
| C1 | C2 | H10 | 109.0° | 109.5° |
| C6 | C5 | C4 | 119.4° | 119.6° |
| C5 | C6 | C7 | 118.7° | 118.3° |
| C6 | C5 | H1 | 120.3° | 120.2° |
| C5 | C6 | H2 | 120.6° | 120.8° |
| C5 | C4 | N9 | 121.0° | 121.3° |
| C4 | C5 | H1 | 120.3° | 120.2° |
| C6 | C7 | C8 | 118.6° | 119.0° |
| C6 | C7 | N12 | 134.1° | 133.7° |
| C7 | C6 | H2 | 120.7° | 120.9° |
| C4 | N9 | C8 | 121.9° | 121.4° |
| N9 | C8 | C7 | 120.3° | 120.4° |
| N9 | C8 | C10 | 133.8° | 133.7° |
| C8 | C7 | N12 | 107.2° | 107.4° |
| C7 | C8 | C10 | 105.9° | 105.9° |
| C7 | N12 | C11 | 109.8° | 109.8° |
| C7 | N12 | H4 | 125.1° | 125.2° |
| C8 | C10 | C11 | 107.0° | 107.1° |
| C8 | C10 | H3 | 126.5° | 126.5° |
| N12 | C11 | C10 | 110.0° | 109.9° |
| C11 | N12 | H4 | 125.1° | 125.1° |
| N12 | C11 | H11 | 125.0° | 125.0° |
| C11 | C10 | H3 | 126.5° | 126.4° |
| C10 | C11 | H11 | 125.0° | 125.0° |
| H7 | C1 | H8 | 109.5° | 109.5° |
| H7 | C1 | H9 | 109.5° | 109.5° |
| H8 | C1 | H9 | 109.5° | 109.4° |
| H17 | C29 | H18 | 109.5° | 115.5° |
| H19 | C30 | H20 | 109.4° | 115.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C17 | C18 | C19 | H13 | 180.0° | 179.8° |
| C17 | C18 | C19 | N21 | 180.0° | 180.0° |
| C18 | C17 | N16 | H5 | 180.0° | 180.0° |
| C17 | C18 | C19 | N20 | 0.0° | 0.3° |
| C18 | C17 | N16 | C15 | 0.0° | 0.1° |
| C18 | C19 | N21 | N20 | 179.9° | 179.7° |
| C18 | C19 | N21 | C22 | 172.3° | 174.7° |
| C19 | C18 | C17 | N16 | 0.1° | 0.2° |
| C18 | C19 | N20 | C15 | 0.3° | 0.0° |
| C19 | C18 | C17 | H5 | 179.9° | 179.8° |
| C18 | C19 | N21 | H14 | 7.7° | 5.4° |
| N27 | C22 | N21 | C19 | 167.0° | 173.8° |
| N27 | C22 | N21 | C23 | 179.3° | 179.6° |
| C22 | N27 | N25 | C24 | 0.0° | 0.2° |
| N27 | C22 | C23 | C24 | 0.5° | 0.3° |
| N27 | C22 | N21 | H14 | 13.0° | 6.3° |
| N27 | C22 | C23 | H15 | 179.5° | 179.7° |
| C22 | N27 | N25 | H16 | 180.0° | 179.8° |
| N25 | N27 | C22 | N21 | 179.7° | 179.7° |
| N25 | N27 | C22 | C23 | 0.3° | 0.1° |
| N27 | N25 | C24 | H16 | 180.0° | 180.0° |
| N27 | N25 | C24 | C23 | 0.3° | 0.4° |
| N27 | N25 | C24 | C28 | 179.6° | 180.0° |
| C19 | N21 | C22 | H14 | 180.0° | 179.9° |
| C19 | N21 | C22 | C23 | 13.7° | 5.8° |
| N21 | C19 | N20 | C15 | 179.8° | 179.7° |
| N21 | C19 | C18 | H13 | 0.0° | 0.3° |
| C22 | N21 | C19 | N20 | 7.8° | 5.0° |
| N21 | C22 | C23 | C24 | 179.8° | 179.9° |
| N21 | C22 | C23 | H15 | 0.2° | 0.1° |
| C17 | N16 | C15 | N20 | 0.2° | 0.4° |
| C17 | N16 | C15 | N14 | 179.6° | 180.0° |
| N16 | C17 | C18 | H13 | 179.9° | 180.0° |
| C19 | N20 | C15 | N16 | 0.4° | 0.3° |
| C19 | N20 | C15 | N14 | 179.7° | 180.0° |
| N20 | C19 | C18 | H13 | 179.9° | 180.0° |
| N20 | C19 | N21 | H14 | 172.2° | 174.9° |
| C22 | C23 | C24 | N25 | 0.5° | 0.4° |
| C22 | C23 | C24 | H15 | 180.0° | 180.0° |
| C22 | C23 | C24 | C28 | 179.8° | 180.0° |
| C23 | C22 | N21 | H14 | 166.3° | 174.1° |
| N25 | C24 | C23 | C28 | 179.3° | 179.6° |
| N25 | C24 | C28 | C30 | 130.9° | 35.5° |
| N25 | C24 | C28 | C29 | 159.7° | 33.2° |
| N25 | C24 | C28 | H6 | 12.6° | 178.8° |
| N25 | C24 | C23 | H15 | 179.5° | 179.6° |
| N16 | C15 | N20 | N14 | 179.3° | 179.6° |
| N16 | C15 | N14 | C2 | 176.1° | 0.1° |
| C15 | N16 | C17 | H5 | 180.0° | 179.9° |
| N16 | C15 | N14 | H12 | 62.5° | 180.0° |
| N20 | C15 | N14 | C2 | 3.2° | 179.7° |
| N20 | C15 | N14 | H12 | 118.2° | 0.3° |
| C23 | C24 | C28 | C30 | 48.3° | 145.0° |
| C23 | C24 | C28 | C29 | 21.1° | 146.4° |
| C23 | C24 | C28 | H6 | 168.2° | 0.7° |
| C23 | C24 | N25 | H16 | 179.7° | 179.6° |
| C24 | C28 | C30 | C29 | 110.3° | 107.5° |
| C24 | C28 | C30 | H6 | 143.6° | 145.0° |
| C24 | C28 | C29 | H6 | 147.2° | 145.0° |
| C28 | C24 | C23 | H15 | 0.2° | 0.0° |
| C28 | C24 | N25 | H16 | 0.4° | 0.0° |
| C24 | C28 | C29 | H17 | 144.0° | 145.0° |
| C24 | C28 | C29 | H18 | 2.9° | 0.0° |
| C24 | C28 | C30 | H19 | 0.8° | 0.0° |
| C24 | C28 | C30 | H20 | 140.2° | 145.0° |
| C15 | N14 | C2 | H12 | 121.4° | 180.0° |
| C15 | N14 | C2 | C4 | 89.1° | 155.0° |
| C15 | N14 | C2 | C1 | 151.8° | 85.0° |
| C15 | N14 | C2 | H10 | 32.3° | 35.1° |
| C30 | C28 | C29 | H6 | 106.2° | 107.5° |
| C28 | C30 | C29 | H19 | 109.5° | 107.4° |
| C28 | C30 | C29 | H20 | 109.5° | 107.5° |
| C30 | C28 | C29 | H17 | 109.5° | 107.5° |
| C30 | C28 | C29 | H18 | 109.4° | 107.5° |
| C28 | C30 | H19 | H20 | 144.7° | 145.6° |
| C28 | C29 | H17 | H18 | 144.7° | 145.7° |
| N14 | C2 | C4 | C1 | 119.7° | 120.0° |
| N14 | C2 | C4 | H10 | 121.8° | 120.0° |
| N14 | C2 | C1 | H10 | 120.0° | 120.1° |
| N14 | C2 | C4 | C5 | 0.0° | 154.7° |
| N14 | C2 | C4 | N9 | 179.5° | 25.0° |
| N14 | C2 | C1 | H7 | 180.0° | 180.0° |
| N14 | C2 | C1 | H8 | 60.0° | 60.0° |
| N14 | C2 | C1 | H9 | 60.0° | 59.9° |
| C30 | C29 | H17 | H18 | 144.8° | 145.6° |
| C29 | C30 | H19 | H20 | 144.7° | 145.8° |
| C4 | C2 | C1 | H10 | 118.6° | 119.9° |
| C2 | C4 | C5 | C6 | 179.6° | 179.7° |
| C2 | C4 | C5 | N9 | 179.4° | 179.7° |
| C2 | C4 | N9 | C8 | 179.6° | 179.7° |
| C2 | C4 | C5 | H1 | 0.4° | 0.2° |
| C4 | C2 | C1 | H7 | 58.6° | 60.0° |
| C4 | C2 | C1 | H8 | 178.7° | 180.0° |
| C4 | C2 | C1 | H9 | 61.3° | 60.0° |
| C4 | C2 | N14 | H12 | 149.5° | 25.0° |
| C1 | C2 | C4 | C5 | 119.7° | 85.2° |
| C1 | C2 | C4 | N9 | 59.8° | 95.0° |
| C2 | C1 | H7 | H8 | 120.0° | 119.9° |
| C2 | C1 | H7 | H9 | 120.0° | 120.0° |
| C2 | C1 | H8 | H9 | 120.0° | 119.9° |
| C1 | C2 | N14 | H12 | 30.4° | 95.0° |
| C6 | C5 | C4 | H1 | 180.0° | 179.9° |
| C5 | C6 | C7 | H2 | 180.0° | 180.0° |
| C6 | C5 | C4 | N9 | 0.2° | 0.0° |
| C5 | C6 | C7 | C8 | 0.1° | 0.1° |
| C5 | C6 | C7 | N12 | 179.9° | 180.0° |
| C4 | C5 | C6 | C7 | 0.2° | 0.0° |
| C5 | C4 | N9 | C8 | 0.1° | 0.0° |
| C4 | C5 | C6 | H2 | 179.8° | 180.0° |
| C5 | C4 | C2 | H10 | 121.9° | 34.7° |
| C6 | C7 | C8 | N9 | 0.0° | 0.1° |
| C6 | C7 | C8 | N12 | 180.0° | 179.9° |
| C6 | C7 | C8 | C10 | 180.0° | 180.0° |
| C6 | C7 | N12 | C11 | 179.9° | 180.0° |
| C7 | C6 | C5 | H1 | 179.8° | 179.9° |
| C6 | C7 | N12 | H4 | 0.1° | 0.0° |
| C4 | N9 | C8 | C7 | 0.0° | 0.0° |
| C4 | N9 | C8 | C10 | 180.0° | 180.0° |
| N9 | C4 | C5 | H1 | 179.8° | 179.9° |
| N9 | C4 | C2 | H10 | 58.7° | 145.0° |
| N9 | C8 | C7 | C10 | 180.0° | 180.0° |
| N9 | C8 | C7 | N12 | 180.0° | 180.0° |
| N9 | C8 | C10 | C11 | 179.9° | 180.0° |
| N9 | C8 | C10 | H3 | 0.2° | 0.1° |
| C8 | C7 | N12 | C11 | 0.1° | 0.0° |
| C7 | C8 | C10 | C11 | 0.1° | 0.0° |
| C8 | C7 | C6 | H2 | 179.9° | 180.0° |
| C7 | C8 | C10 | H3 | 179.9° | 179.9° |
| C8 | C7 | N12 | H4 | 179.9° | 179.9° |
| N12 | C7 | C8 | C10 | 0.0° | 0.0° |
| C7 | N12 | C11 | H4 | 180.0° | 180.0° |
| C7 | N12 | C11 | C10 | 0.2° | 0.0° |
| N12 | C7 | C6 | H2 | 0.1° | 0.1° |
| C7 | N12 | C11 | H11 | 179.8° | 180.0° |
| C8 | C10 | C11 | N12 | 0.2° | 0.0° |
| C8 | C10 | C11 | H3 | 180.0° | 179.9° |
| C8 | C10 | C11 | H11 | 179.8° | 180.0° |
| N12 | C11 | C10 | H11 | 180.0° | 180.0° |
| N12 | C11 | C10 | H3 | 179.8° | 179.9° |
| C10 | C11 | N12 | H4 | 179.8° | 179.9° |
| H1 | C5 | C6 | H2 | 0.2° | 0.1° |
| H3 | C10 | C11 | H11 | 0.2° | 0.1° |
| H4 | N12 | C11 | H11 | 0.2° | 0.0° |
| H5 | C17 | C18 | H13 | 0.1° | 0.0° |
| H6 | C28 | C29 | H17 | 3.3° | 0.0° |
| H6 | C28 | C29 | H18 | 144.3° | 145.0° |
| H6 | C28 | C30 | H19 | 144.3° | 145.0° |
| H6 | C28 | C30 | H20 | 3.4° | 0.0° |
| H7 | C1 | H8 | H9 | 120.0° | 120.1° |
| H7 | C1 | C2 | H10 | 60.0° | 59.9° |
| H8 | C1 | C2 | H10 | 60.0° | 60.1° |
| H9 | C1 | C2 | H10 | 180.0° | 180.0° |
| H10 | C2 | N14 | H12 | 89.0° | 145.0° |
| H17 | C29 | C30 | H19 | 141.1° | 145.0° |
| H17 | C29 | C30 | H20 | 0.0° | 0.1° |
| H18 | C29 | C30 | H19 | 0.0° | 0.1° |
| H18 | C29 | C30 | H20 | 141.1° | 145.0° |
