L7V
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | C5 | doub | 1.32Å | 1.34Å | Aromatic |
| N | C6 | sing | 1.32Å | 1.34Å | Aromatic |
| C5 | C4 | sing | 1.38Å | 1.38Å | Aromatic |
| C6 | C2 | doub | 1.38Å | 1.38Å | Aromatic |
| C4 | C3 | doub | 1.39Å | 1.38Å | Aromatic |
| C2 | C3 | sing | 1.39Å | 1.39Å | Aromatic |
| C2 | C1 | sing | 1.51Å | 1.51Å | |
| C1 | C | sing | 1.51Å | 1.52Å | |
| O | C | doub | 1.21Å | 1.22Å | |
| C | N1 | sing | 1.35Å | 1.36Å | |
| C14 | C13 | sing | 1.53Å | 1.50Å | |
| C14 | C15 | sing | 1.53Å | 1.48Å | |
| C13 | C12 | sing | 1.51Å | 1.48Å | |
| C13 | C15 | sing | 1.53Å | 1.50Å | |
| C12 | N3 | doub | 1.31Å | 1.29Å | Aromatic |
| C12 | O1 | sing | 1.34Å | 1.34Å | Aromatic |
| N1 | C10 | sing | 1.47Å | 1.47Å | |
| N1 | C7 | sing | 1.47Å | 1.48Å | |
| N3 | C11 | sing | 1.34Å | 1.37Å | Aromatic |
| O1 | N2 | sing | 1.21Å | 1.42Å | Aromatic |
| C11 | N2 | doub | 1.30Å | 1.30Å | Aromatic |
| C11 | C10 | sing | 1.51Å | 1.51Å | |
| C10 | C9 | sing | 1.54Å | 1.54Å | |
| C7 | C8 | sing | 1.55Å | 1.51Å | |
| C8 | C9 | sing | 1.55Å | 1.53Å | |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C5 | H2 | sing | 1.08Å | 1.08Å | |
| C6 | H3 | sing | 1.08Å | 1.08Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H8 | sing | 1.09Å | 1.10Å | |
| C13 | H9 | sing | 1.09Å | 1.10Å | |
| C15 | H10 | sing | 1.09Å | 1.10Å | |
| C15 | H11 | sing | 1.09Å | 1.10Å | |
| C1 | H12 | sing | 1.09Å | 1.10Å | |
| C1 | H13 | sing | 1.09Å | 1.10Å | |
| C9 | H14 | sing | 1.09Å | 1.10Å | |
| C9 | H15 | sing | 1.09Å | 1.10Å | |
| C14 | H16 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.09Å | 1.10Å | |
| C3 | H18 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C5 | N | C6 | 117.4° | 121.7° |
| N | C5 | C4 | 123.2° | 120.8° |
| N | C5 | H2 | 118.4° | 119.6° |
| N | C6 | C2 | 124.0° | 120.8° |
| N | C6 | H3 | 118.0° | 119.6° |
| C5 | C4 | C3 | 118.1° | 119.2° |
| C5 | C4 | H1 | 120.9° | 120.4° |
| C4 | C5 | H2 | 118.4° | 119.6° |
| C6 | C2 | C3 | 117.3° | 119.2° |
| C6 | C2 | C1 | 120.9° | 120.4° |
| C2 | C6 | H3 | 118.0° | 119.6° |
| C4 | C3 | C2 | 120.0° | 118.4° |
| C3 | C4 | H1 | 121.0° | 120.4° |
| C4 | C3 | H18 | 120.0° | 120.8° |
| C3 | C2 | C1 | 121.7° | 120.4° |
| C2 | C3 | H18 | 120.0° | 120.8° |
| C2 | C1 | C | 109.5° | 109.5° |
| C2 | C1 | H12 | 109.5° | 109.5° |
| C2 | C1 | H13 | 109.4° | 109.5° |
| C1 | C | O | 120.6° | 120.0° |
| C1 | C | N1 | 117.5° | 120.0° |
| C | C1 | H12 | 109.5° | 109.5° |
| C | C1 | H13 | 109.5° | 109.5° |
| O | C | N1 | 121.9° | 120.0° |
| C | N1 | C10 | 123.2° | 125.6° |
| C | N1 | C7 | 124.6° | 125.7° |
| C13 | C14 | C15 | 60.5° | 60.0° |
| C14 | C13 | C12 | 118.7° | 117.5° |
| C14 | C13 | C15 | 59.1° | 60.0° |
| C14 | C13 | H9 | 116.0° | 117.5° |
| C13 | C14 | H16 | 119.9° | 117.5° |
| C13 | C14 | H17 | 119.9° | 117.5° |
| C14 | C15 | C13 | 60.4° | 60.0° |
| C14 | C15 | H10 | 119.9° | 117.5° |
| C14 | C15 | H11 | 119.9° | 117.5° |
| C15 | C14 | H16 | 119.9° | 117.5° |
| C15 | C14 | H17 | 119.9° | 117.5° |
| C12 | C13 | C15 | 118.4° | 117.5° |
| C13 | C12 | N3 | 128.0° | 126.6° |
| C13 | C12 | O1 | 118.7° | 126.6° |
| C12 | C13 | H9 | 116.4° | 115.6° |
| C15 | C13 | H9 | 116.0° | 117.5° |
| C13 | C15 | H10 | 119.9° | 117.6° |
| C13 | C15 | H11 | 119.9° | 117.5° |
| N3 | C12 | O1 | 113.3° | 106.9° |
| C12 | N3 | C11 | 103.0° | 105.6° |
| C12 | O1 | N2 | 106.0° | 109.8° |
| C10 | N1 | C7 | 112.2° | 108.7° |
| N1 | C10 | C11 | 110.5° | 109.9° |
| N1 | C10 | C9 | 103.2° | 107.3° |
| N1 | C10 | H8 | 110.5° | 109.9° |
| N1 | C7 | C8 | 103.2° | 104.8° |
| N1 | C7 | H4 | 111.0° | 110.4° |
| N1 | C7 | H5 | 111.0° | 110.4° |
| N3 | C11 | N2 | 114.7° | 107.5° |
| N3 | C11 | C10 | 119.2° | 126.3° |
| O1 | N2 | C11 | 103.0° | 110.3° |
| N2 | C11 | C10 | 126.1° | 126.2° |
| C11 | C10 | C9 | 112.9° | 109.9° |
| C11 | C10 | H8 | 110.0° | 109.9° |
| C10 | C9 | C8 | 104.5° | 102.9° |
| C9 | C10 | H8 | 109.5° | 109.9° |
| C10 | C9 | H14 | 110.7° | 110.7° |
| C10 | C9 | H15 | 110.7° | 110.7° |
| C7 | C8 | C9 | 103.2° | 101.6° |
| C8 | C7 | H4 | 111.0° | 110.4° |
| C8 | C7 | H5 | 111.0° | 110.4° |
| C7 | C8 | H6 | 111.0° | 111.0° |
| C7 | C8 | H7 | 111.0° | 111.0° |
| C9 | C8 | H6 | 111.0° | 111.0° |
| C9 | C8 | H7 | 111.0° | 111.0° |
| C8 | C9 | H14 | 110.7° | 110.7° |
| C8 | C9 | H15 | 110.7° | 110.7° |
| H4 | C7 | H5 | 109.5° | 110.4° |
| H6 | C8 | H7 | 109.5° | 110.9° |
| H10 | C15 | H11 | 109.5° | 115.5° |
| H12 | C1 | H13 | 109.4° | 109.4° |
| H14 | C9 | H15 | 109.4° | 110.8° |
| H16 | C14 | H17 | 109.4° | 115.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N | C5 | C4 | H2 | 180.0° | 180.0° |
| C5 | N | C6 | C2 | 0.2° | 0.2° |
| N | C5 | C4 | C3 | 0.1° | 0.0° |
| N | C5 | C4 | H1 | 179.9° | 179.7° |
| C5 | N | C6 | H3 | 179.8° | 179.7° |
| C6 | N | C5 | C4 | 0.3° | 0.0° |
| N | C6 | C2 | H3 | 180.0° | 179.5° |
| N | C6 | C2 | C3 | 0.1° | 0.5° |
| N | C6 | C2 | C1 | 176.8° | 179.5° |
| C6 | N | C5 | H2 | 179.7° | 180.0° |
| C5 | C4 | C3 | H1 | 180.0° | 179.7° |
| C5 | C4 | C3 | C2 | 0.2° | 0.3° |
| C5 | C4 | C3 | H18 | 179.8° | 179.7° |
| C6 | C2 | C3 | C4 | 0.3° | 0.5° |
| C6 | C2 | C3 | C1 | 176.7° | 179.9° |
| C6 | C2 | C1 | C | 100.7° | 90.1° |
| C6 | C2 | C1 | H12 | 139.2° | 150.0° |
| C6 | C2 | C1 | H13 | 19.3° | 30.0° |
| C6 | C2 | C3 | H18 | 179.7° | 179.5° |
| C4 | C3 | C2 | H18 | 180.0° | 180.0° |
| C4 | C3 | C2 | C1 | 177.0° | 179.5° |
| C3 | C4 | C5 | H2 | 179.9° | 180.0° |
| C3 | C2 | C1 | C | 75.8° | 90.0° |
| C2 | C3 | C4 | H1 | 179.8° | 179.9° |
| C3 | C2 | C6 | H3 | 179.9° | 180.0° |
| C3 | C2 | C1 | H12 | 44.2° | 30.0° |
| C3 | C2 | C1 | H13 | 164.2° | 150.0° |
| C2 | C1 | C | H12 | 120.0° | 120.0° |
| C2 | C1 | C | H13 | 120.0° | 120.0° |
| C2 | C1 | C | O | 40.7° | 0.0° |
| C2 | C1 | C | N1 | 136.9° | 180.0° |
| C1 | C2 | C6 | H3 | 3.2° | 0.0° |
| C2 | C1 | H12 | H13 | 120.0° | 120.0° |
| C1 | C2 | C3 | H18 | 3.0° | 0.5° |
| C1 | C | O | N1 | 177.5° | 179.9° |
| C1 | C | N1 | C10 | 169.8° | 180.0° |
| C1 | C | N1 | C7 | 9.1° | 0.2° |
| C | C1 | H12 | H13 | 120.0° | 120.0° |
| O | C | N1 | C10 | 12.6° | 0.1° |
| O | C | N1 | C7 | 168.5° | 179.7° |
| O | C | C1 | H12 | 160.8° | 120.0° |
| O | C | C1 | H13 | 79.3° | 120.0° |
| C | N1 | C10 | C7 | 179.1° | 179.8° |
| C | N1 | C10 | C11 | 61.7° | 61.4° |
| C | N1 | C10 | C9 | 177.3° | 179.2° |
| C | N1 | C7 | C8 | 160.0° | 156.1° |
| C | N1 | C7 | H4 | 81.0° | 37.3° |
| C | N1 | C7 | H5 | 41.0° | 85.1° |
| C | N1 | C10 | H8 | 60.3° | 59.7° |
| N1 | C | C1 | H12 | 16.9° | 60.0° |
| N1 | C | C1 | H13 | 103.1° | 59.9° |
| C13 | C14 | C15 | H16 | 109.6° | 107.4° |
| C13 | C14 | C15 | H17 | 109.6° | 107.5° |
| C14 | C13 | C12 | C15 | 68.3° | 68.6° |
| C14 | C13 | C12 | H9 | 146.1° | 145.7° |
| C14 | C13 | C15 | H9 | 106.1° | 107.5° |
| C14 | C13 | C12 | N3 | 153.9° | 171.4° |
| C14 | C13 | C12 | O1 | 23.6° | 8.6° |
| C13 | C14 | C15 | H10 | 109.6° | 107.6° |
| C13 | C14 | C15 | H11 | 109.6° | 107.5° |
| C13 | C14 | H16 | H17 | 144.5° | 145.6° |
| C14 | C15 | H10 | H11 | 144.5° | 145.6° |
| C15 | C14 | H16 | H17 | 144.4° | 145.8° |
| C12 | C13 | C15 | H9 | 145.7° | 145.0° |
| C13 | C12 | N3 | O1 | 177.6° | 180.0° |
| C13 | C12 | N3 | C11 | 177.0° | 179.9° |
| C13 | C12 | O1 | N2 | 177.1° | 180.0° |
| C12 | C13 | C15 | H10 | 142.3° | 0.0° |
| C12 | C13 | C15 | H11 | 1.4° | 145.0° |
| C12 | C13 | C14 | H16 | 142.7° | 145.0° |
| C12 | C13 | C14 | H17 | 1.9° | 0.0° |
| C15 | C13 | C12 | N3 | 137.8° | 120.0° |
| C15 | C13 | C12 | O1 | 44.7° | 59.9° |
| C13 | C15 | H10 | H11 | 144.6° | 145.7° |
| N3 | C12 | O1 | N2 | 0.7° | 0.0° |
| C12 | N3 | C11 | N2 | 0.2° | 0.0° |
| C12 | N3 | C11 | C10 | 178.5° | 180.0° |
| N3 | C12 | C13 | H9 | 7.8° | 25.7° |
| O1 | C12 | N3 | C11 | 0.6° | 0.0° |
| C12 | O1 | N2 | C11 | 0.5° | 0.0° |
| O1 | C12 | C13 | H9 | 169.7° | 154.4° |
| N1 | C10 | C11 | N3 | 27.1° | 135.1° |
| N1 | C10 | C11 | N2 | 151.4° | 45.0° |
| N1 | C10 | C11 | C9 | 115.1° | 117.8° |
| N1 | C10 | C11 | H8 | 122.3° | 121.1° |
| N1 | C10 | C9 | H8 | 117.7° | 119.5° |
| C10 | N1 | C7 | C8 | 19.1° | 24.1° |
| N1 | C10 | C9 | C8 | 24.8° | 22.2° |
| C10 | N1 | C7 | H4 | 99.9° | 142.9° |
| C10 | N1 | C7 | H5 | 138.1° | 94.7° |
| N1 | C10 | C9 | H14 | 144.0° | 140.5° |
| N1 | C10 | C9 | H15 | 94.4° | 96.1° |
| C7 | N1 | C10 | C11 | 117.4° | 118.4° |
| C7 | N1 | C10 | C9 | 3.6° | 1.0° |
| N1 | C7 | C8 | H4 | 119.0° | 118.8° |
| N1 | C7 | C8 | H5 | 119.0° | 118.9° |
| N1 | C7 | C8 | C9 | 33.7° | 37.0° |
| N1 | C7 | H4 | H5 | 122.9° | 122.3° |
| N1 | C7 | C8 | H6 | 152.7° | 81.1° |
| N1 | C7 | C8 | H7 | 85.3° | 155.1° |
| C7 | N1 | C10 | H8 | 120.6° | 120.5° |
| N3 | C11 | N2 | O1 | 0.2° | 0.0° |
| N3 | C11 | N2 | C10 | 178.6° | 180.0° |
| N3 | C11 | C10 | C9 | 88.0° | 107.1° |
| N3 | C11 | C10 | H8 | 149.3° | 14.0° |
| O1 | N2 | C11 | C10 | 178.8° | 180.0° |
| N2 | C11 | C10 | C9 | 93.5° | 72.8° |
| N2 | C11 | C10 | H8 | 29.2° | 166.1° |
| C11 | C10 | C9 | H8 | 122.9° | 121.1° |
| C11 | C10 | C9 | C8 | 94.5° | 141.7° |
| C11 | C10 | C9 | H14 | 24.7° | 100.1° |
| C11 | C10 | C9 | H15 | 146.2° | 23.3° |
| C10 | C9 | C8 | C7 | 36.7° | 35.5° |
| C10 | C9 | C8 | H14 | 119.2° | 118.4° |
| C10 | C9 | C8 | H15 | 119.2° | 118.4° |
| C10 | C9 | C8 | H6 | 155.7° | 82.5° |
| C10 | C9 | C8 | H7 | 82.3° | 153.6° |
| C10 | C9 | H14 | H15 | 122.3° | 123.3° |
| C7 | C8 | C9 | H6 | 119.0° | 118.1° |
| C7 | C8 | C9 | H7 | 119.0° | 118.0° |
| C8 | C7 | H4 | H5 | 122.9° | 122.3° |
| C7 | C8 | H6 | H7 | 122.9° | 123.9° |
| C7 | C8 | C9 | H14 | 155.9° | 153.9° |
| C7 | C8 | C9 | H15 | 82.5° | 82.9° |
| C9 | C8 | C7 | H4 | 85.3° | 155.9° |
| C9 | C8 | C7 | H5 | 152.7° | 81.8° |
| C9 | C8 | H6 | H7 | 123.0° | 123.9° |
| C8 | C9 | C10 | H8 | 142.5° | 97.2° |
| C8 | C9 | H14 | H15 | 122.3° | 123.2° |
| H1 | C4 | C5 | H2 | 0.1° | 0.3° |
| H1 | C4 | C3 | H18 | 0.2° | 0.0° |
| H4 | C7 | C8 | H6 | 33.7° | 37.8° |
| H4 | C7 | C8 | H7 | 155.7° | 86.1° |
| H5 | C7 | C8 | H6 | 88.3° | 160.1° |
| H5 | C7 | C8 | H7 | 33.7° | 36.2° |
| H6 | C8 | C9 | H14 | 85.1° | 35.8° |
| H6 | C8 | C9 | H15 | 36.4° | 159.1° |
| H7 | C8 | C9 | H14 | 37.0° | 88.1° |
| H7 | C8 | C9 | H15 | 158.5° | 35.2° |
| H8 | C10 | C9 | H14 | 98.2° | 21.1° |
| H8 | C10 | C9 | H15 | 23.3° | 144.4° |
| H9 | C13 | C15 | H10 | 3.5° | 145.0° |
| H9 | C13 | C15 | H11 | 144.3° | 0.0° |
| H9 | C13 | C14 | H16 | 3.6° | 0.1° |
| H9 | C13 | C14 | H17 | 144.3° | 145.0° |
| H10 | C15 | C14 | H16 | 0.0° | 145.0° |
| H10 | C15 | C14 | H17 | 140.8° | 0.1° |
| H11 | C15 | C14 | H16 | 140.8° | 0.1° |
| H11 | C15 | C14 | H17 | 0.0° | 145.0° |
