Y2V
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | C1 | sing | 1.51Å | 1.48Å | |
| C1 | C2 | doub | 1.35Å | 1.34Å | Aromatic |
| C2 | C3 | sing | 1.40Å | 1.41Å | Aromatic |
| C3 | C4 | doub | 1.37Å | 1.35Å | Aromatic |
| C4 | C5 | sing | 1.47Å | 1.49Å | |
| O | C5 | doub | 1.22Å | 1.22Å | |
| C5 | N | sing | 1.35Å | 1.34Å | |
| N | C6 | sing | 1.47Å | 1.47Å | |
| C6 | C7 | sing | 1.53Å | 1.51Å | |
| C7 | N1 | sing | 1.47Å | 1.48Å | |
| N1 | C8 | sing | 1.35Å | 1.36Å | |
| O1 | C8 | doub | 1.22Å | 1.22Å | |
| C8 | N2 | sing | 1.35Å | 1.34Å | |
| N2 | C9 | sing | 1.46Å | 1.45Å | |
| C9 | C10 | sing | 1.53Å | 1.49Å | |
| F | C10 | sing | 1.40Å | 1.32Å | |
| F1 | C10 | sing | 1.40Å | 1.33Å | |
| C10 | F2 | sing | 1.40Å | 1.32Å | |
| C11 | N1 | sing | 1.47Å | 1.47Å | |
| C12 | C11 | sing | 1.53Å | 1.51Å | |
| N | C12 | sing | 1.47Å | 1.47Å | |
| O2 | C4 | sing | 1.35Å | 1.37Å | Aromatic |
| C1 | O2 | sing | 1.34Å | 1.38Å | Aromatic |
| C6 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C7 | H8 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C | H2 | sing | 1.09Å | 1.10Å | |
| C | H1 | sing | 1.09Å | 1.10Å | |
| C | H | sing | 1.09Å | 1.10Å | |
| C11 | H12 | sing | 1.09Å | 1.10Å | |
| C11 | H13 | sing | 1.09Å | 1.10Å | |
| C12 | H15 | sing | 1.09Å | 1.10Å | |
| C12 | H14 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.08Å | 1.08Å | |
| C3 | H4 | sing | 1.08Å | 1.08Å | |
| C9 | H10 | sing | 1.09Å | 1.10Å | |
| C9 | H11 | sing | 1.09Å | 1.10Å | |
| N2 | H9 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C | C1 | C2 | 134.2° | 125.6° |
| C | C1 | O2 | 115.9° | 125.7° |
| C1 | C | H2 | 109.5° | 109.4° |
| C1 | C | H1 | 109.5° | 109.4° |
| C1 | C | H | 109.5° | 109.5° |
| C1 | C2 | C3 | 107.5° | 107.1° |
| C2 | C1 | O2 | 109.8° | 108.7° |
| C1 | C2 | H3 | 126.3° | 126.4° |
| C2 | C3 | C4 | 107.0° | 106.7° |
| C3 | C2 | H3 | 126.3° | 126.5° |
| C2 | C3 | H4 | 126.5° | 126.6° |
| C3 | C4 | C5 | 127.7° | 126.0° |
| C3 | C4 | O2 | 109.5° | 108.0° |
| C4 | C3 | H4 | 126.5° | 126.7° |
| C4 | C5 | O | 116.5° | 120.0° |
| C4 | C5 | N | 122.3° | 120.0° |
| C5 | C4 | O2 | 122.7° | 126.0° |
| O | C5 | N | 121.1° | 120.0° |
| C5 | N | C6 | 128.0° | 120.6° |
| C5 | N | C12 | 120.5° | 120.5° |
| N | C6 | C7 | 109.1° | 108.6° |
| C6 | N | C12 | 111.5° | 118.9° |
| N | C6 | H5 | 109.6° | 109.7° |
| N | C6 | H6 | 109.6° | 109.7° |
| C6 | C7 | N1 | 110.4° | 108.6° |
| C7 | C6 | H5 | 109.6° | 109.6° |
| C7 | C6 | H6 | 109.6° | 109.6° |
| C6 | C7 | H8 | 109.2° | 109.6° |
| C6 | C7 | H7 | 109.2° | 109.6° |
| C7 | N1 | C8 | 120.1° | 120.6° |
| C7 | N1 | C11 | 114.5° | 118.8° |
| N1 | C7 | H8 | 109.2° | 109.6° |
| N1 | C7 | H7 | 109.2° | 109.6° |
| N1 | C8 | O1 | 120.8° | 120.0° |
| N1 | C8 | N2 | 117.4° | 120.0° |
| C8 | N1 | C11 | 124.4° | 120.6° |
| O1 | C8 | N2 | 121.7° | 120.0° |
| C8 | N2 | C9 | 122.5° | 120.0° |
| C8 | N2 | H9 | 118.8° | 120.0° |
| N2 | C9 | C10 | 112.2° | 109.5° |
| N2 | C9 | H10 | 108.8° | 109.5° |
| N2 | C9 | H11 | 108.8° | 109.5° |
| C9 | N2 | H9 | 118.8° | 120.0° |
| C9 | C10 | F | 112.1° | 109.4° |
| C9 | C10 | F1 | 112.5° | 109.5° |
| C9 | C10 | F2 | 112.8° | 109.5° |
| C10 | C9 | H10 | 108.8° | 109.5° |
| C10 | C9 | H11 | 108.8° | 109.5° |
| F | C10 | F1 | 107.8° | 109.5° |
| F | C10 | F2 | 105.8° | 109.5° |
| F1 | C10 | F2 | 105.4° | 109.5° |
| N1 | C11 | C12 | 110.0° | 108.6° |
| N1 | C11 | H12 | 109.3° | 109.6° |
| N1 | C11 | H13 | 109.3° | 109.6° |
| C11 | C12 | N | 109.5° | 108.6° |
| C12 | C11 | H12 | 109.3° | 109.6° |
| C12 | C11 | H13 | 109.3° | 109.7° |
| C11 | C12 | H15 | 109.5° | 109.8° |
| C11 | C12 | H14 | 109.5° | 109.4° |
| N | C12 | H15 | 109.5° | 109.6° |
| N | C12 | H14 | 109.5° | 109.6° |
| C4 | O2 | C1 | 106.2° | 109.4° |
| H5 | C6 | H6 | 109.5° | 109.6° |
| H8 | C7 | H7 | 109.4° | 109.8° |
| H2 | C | H1 | 109.5° | 109.5° |
| H2 | C | H | 109.5° | 109.5° |
| H1 | C | H | 109.4° | 109.5° |
| H12 | C11 | H13 | 109.5° | 109.7° |
| H15 | C12 | H14 | 109.4° | 109.8° |
| H10 | C9 | H11 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C | C1 | C2 | O2 | 178.9° | 179.9° |
| C | C1 | C2 | C3 | 178.0° | 180.0° |
| C | C1 | O2 | C4 | 177.9° | 179.8° |
| C1 | C | H2 | H1 | 120.0° | 119.9° |
| C1 | C | H2 | H | 120.0° | 120.0° |
| C1 | C | H1 | H | 120.0° | 120.0° |
| C | C1 | C2 | H3 | 2.1° | 0.1° |
| C1 | C2 | C3 | H3 | 180.0° | 180.0° |
| C1 | C2 | C3 | C4 | 0.3° | 0.1° |
| C2 | C1 | O2 | C4 | 1.3° | 0.1° |
| C2 | C1 | C | H2 | 178.9° | 90.0° |
| C2 | C1 | C | H1 | 58.9° | 150.0° |
| C2 | C1 | C | H | 61.1° | 30.0° |
| C1 | C2 | C3 | H4 | 179.7° | 179.9° |
| C2 | C3 | C4 | H4 | 180.0° | 180.0° |
| C2 | C3 | C4 | C5 | 175.4° | 180.0° |
| C2 | C3 | C4 | O2 | 0.5° | 0.2° |
| C3 | C2 | C1 | O2 | 1.0° | 0.0° |
| C3 | C4 | C5 | O2 | 175.4° | 179.8° |
| C3 | C4 | C5 | O | 9.4° | 7.3° |
| C3 | C4 | C5 | N | 173.8° | 172.7° |
| C3 | C4 | O2 | C1 | 1.1° | 0.2° |
| C4 | C3 | C2 | H3 | 179.7° | 179.9° |
| C4 | C5 | O | N | 176.9° | 179.9° |
| C4 | C5 | N | C6 | 14.6° | 6.6° |
| C4 | C5 | N | C12 | 163.0° | 173.7° |
| C5 | C4 | O2 | C1 | 175.1° | 180.0° |
| C5 | C4 | C3 | H4 | 4.6° | 0.0° |
| O | C5 | N | C6 | 168.7° | 173.4° |
| O | C5 | N | C12 | 13.7° | 6.3° |
| O | C5 | C4 | O2 | 166.1° | 172.9° |
| C5 | N | C6 | C12 | 177.7° | 179.7° |
| C5 | N | C6 | C7 | 116.9° | 124.7° |
| C5 | N | C12 | C11 | 116.4° | 124.7° |
| N | C5 | C4 | O2 | 10.8° | 7.1° |
| C5 | N | C6 | H5 | 3.1° | 5.0° |
| C5 | N | C6 | H6 | 123.2° | 115.5° |
| C5 | N | C12 | H15 | 3.6° | 4.8° |
| C5 | N | C12 | H14 | 123.6° | 115.8° |
| N | C6 | C7 | H5 | 120.0° | 119.8° |
| N | C6 | C7 | H6 | 119.9° | 119.9° |
| N | C6 | C7 | N1 | 54.5° | 49.3° |
| C6 | N | C12 | C11 | 61.6° | 55.0° |
| N | C6 | H5 | H6 | 120.2° | 120.5° |
| N | C6 | C7 | H8 | 65.6° | 70.4° |
| N | C6 | C7 | H7 | 174.7° | 169.1° |
| C6 | N | C12 | H15 | 178.4° | 174.9° |
| C6 | N | C12 | H14 | 58.5° | 64.5° |
| C6 | C7 | N1 | H8 | 120.2° | 119.7° |
| C6 | C7 | N1 | H7 | 120.2° | 119.7° |
| C6 | C7 | N1 | C8 | 138.4° | 124.8° |
| C6 | C7 | N1 | C11 | 52.5° | 55.5° |
| C7 | C6 | N | C12 | 60.9° | 55.0° |
| C7 | C6 | H5 | H6 | 120.2° | 120.3° |
| C6 | C7 | H8 | H7 | 119.6° | 120.4° |
| C7 | N1 | C8 | C11 | 168.0° | 179.7° |
| C7 | N1 | C8 | O1 | 11.8° | 5.3° |
| C7 | N1 | C8 | N2 | 165.4° | 174.7° |
| C7 | N1 | C11 | C12 | 52.7° | 55.5° |
| N1 | C7 | C6 | H5 | 174.5° | 169.2° |
| N1 | C7 | C6 | H6 | 65.4° | 70.5° |
| N1 | C7 | H8 | H7 | 119.5° | 120.4° |
| C7 | N1 | C11 | H12 | 67.4° | 175.2° |
| C7 | N1 | C11 | H13 | 172.7° | 64.4° |
| N1 | C8 | O1 | N2 | 177.1° | 180.0° |
| N1 | C8 | N2 | C9 | 170.4° | 174.9° |
| C8 | N1 | C11 | C12 | 138.7° | 124.8° |
| C8 | N1 | C7 | H8 | 101.4° | 115.5° |
| C8 | N1 | C7 | H7 | 18.2° | 5.0° |
| C8 | N1 | C11 | H12 | 101.2° | 5.1° |
| C8 | N1 | C11 | H13 | 18.7° | 115.4° |
| N1 | C8 | N2 | H9 | 9.6° | 5.1° |
| O1 | C8 | N2 | C9 | 12.4° | 5.2° |
| O1 | C8 | N1 | C11 | 179.8° | 175.0° |
| O1 | C8 | N2 | H9 | 167.6° | 174.8° |
| C8 | N2 | C9 | H9 | 180.0° | 180.0° |
| C8 | N2 | C9 | C10 | 95.6° | 180.0° |
| N2 | C8 | N1 | C11 | 2.6° | 5.0° |
| C8 | N2 | C9 | H10 | 24.8° | 60.0° |
| C8 | N2 | C9 | H11 | 144.0° | 60.0° |
| N2 | C9 | C10 | H10 | 120.4° | 120.0° |
| N2 | C9 | C10 | H11 | 120.4° | 120.0° |
| N2 | C9 | C10 | F | 62.9° | 180.0° |
| N2 | C9 | C10 | F1 | 58.8° | 60.0° |
| N2 | C9 | C10 | F2 | 177.9° | 60.0° |
| N2 | C9 | H10 | H11 | 118.8° | 119.9° |
| C9 | C10 | F | F1 | 124.3° | 120.0° |
| C9 | C10 | F | F2 | 123.3° | 120.0° |
| C9 | C10 | F1 | F2 | 123.3° | 120.0° |
| C10 | C9 | H10 | H11 | 118.7° | 120.0° |
| C10 | C9 | N2 | H9 | 84.3° | 0.0° |
| F | C10 | F1 | F2 | 112.6° | 120.0° |
| F | C10 | C9 | H10 | 176.7° | 60.0° |
| F | C10 | C9 | H11 | 57.5° | 60.0° |
| F1 | C10 | C9 | H10 | 61.6° | 60.0° |
| F1 | C10 | C9 | H11 | 179.3° | 180.0° |
| F2 | C10 | C9 | H10 | 57.5° | 180.0° |
| F2 | C10 | C9 | H11 | 61.7° | 60.0° |
| N1 | C11 | C12 | H12 | 120.1° | 119.8° |
| N1 | C11 | C12 | H13 | 120.1° | 119.8° |
| N1 | C11 | C12 | N | 55.5° | 49.4° |
| C11 | N1 | C7 | H8 | 67.7° | 64.3° |
| C11 | N1 | C7 | H7 | 172.6° | 175.2° |
| N1 | C11 | H12 | H13 | 119.7° | 120.4° |
| N1 | C11 | C12 | H15 | 175.5° | 169.2° |
| N1 | C11 | C12 | H14 | 64.6° | 70.2° |
| C11 | C12 | N | H15 | 120.0° | 119.9° |
| C11 | C12 | N | H14 | 120.0° | 119.5° |
| C12 | C11 | H12 | H13 | 119.7° | 120.4° |
| C11 | C12 | H15 | H14 | 120.0° | 120.3° |
| C12 | N | C6 | H5 | 179.2° | 174.7° |
| C12 | N | C6 | H6 | 59.1° | 64.8° |
| N | C12 | C11 | H12 | 64.6° | 169.2° |
| N | C12 | C11 | H13 | 175.5° | 70.4° |
| N | C12 | H15 | H14 | 120.0° | 120.4° |
| O2 | C4 | C3 | H4 | 179.5° | 179.8° |
| O2 | C1 | C | H2 | 0.0° | 90.1° |
| O2 | C1 | C | H1 | 120.0° | 29.9° |
| O2 | C1 | C | H | 120.0° | 149.9° |
| O2 | C1 | C2 | H3 | 179.0° | 180.0° |
| H5 | C6 | C7 | H8 | 54.3° | 49.4° |
| H5 | C6 | C7 | H7 | 65.4° | 71.1° |
| H6 | C6 | C7 | H8 | 174.4° | 169.8° |
| H6 | C6 | C7 | H7 | 54.7° | 49.2° |
| H2 | C | H1 | H | 120.0° | 120.0° |
| H12 | C11 | C12 | H15 | 55.4° | 71.0° |
| H12 | C11 | C12 | H14 | 175.3° | 49.6° |
| H13 | C11 | C12 | H15 | 64.5° | 49.4° |
| H13 | C11 | C12 | H14 | 55.5° | 170.0° |
| H3 | C2 | C3 | H4 | 0.3° | 0.1° |
| H10 | C9 | N2 | H9 | 155.3° | 120.0° |
| H11 | C9 | N2 | H9 | 36.1° | 120.0° |
