V2Q
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C13 | C10 | sing | 1.47Å | 1.55Å | |
| C10 | C09 | doub | 1.40Å | 1.40Å | Aromatic |
| C10 | C11 | sing | 1.40Å | 1.38Å | Aromatic |
| C09 | C08 | sing | 1.38Å | 1.36Å | Aromatic |
| C11 | C12 | doub | 1.38Å | 1.39Å | Aromatic |
| C08 | C07 | doub | 1.40Å | 1.40Å | Aromatic |
| C12 | C07 | sing | 1.40Å | 1.38Å | Aromatic |
| C07 | C06 | sing | 1.48Å | 1.50Å | |
| C15 | N05 | sing | 1.48Å | 1.51Å | |
| C15 | C03 | sing | 1.54Å | 1.48Å | |
| C06 | N05 | sing | 1.35Å | 1.50Å | |
| C06 | O14 | doub | 1.21Å | 1.19Å | |
| N05 | C04 | sing | 1.48Å | 1.49Å | |
| C03 | C04 | sing | 1.54Å | 1.51Å | |
| C03 | O02 | sing | 1.43Å | 1.43Å | |
| C01 | O02 | sing | 1.43Å | 1.42Å | |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H2 | sing | 1.09Å | 1.10Å | |
| C01 | H3 | sing | 1.09Å | 1.10Å | |
| C03 | H4 | sing | 1.09Å | 1.10Å | |
| C04 | H5 | sing | 1.09Å | 1.10Å | |
| C04 | H6 | sing | 1.09Å | 1.10Å | |
| C08 | H7 | sing | 1.08Å | 1.08Å | |
| C09 | H8 | sing | 1.08Å | 1.08Å | |
| C11 | H9 | sing | 1.08Å | 1.08Å | |
| C12 | H10 | sing | 1.08Å | 1.08Å | |
| C13 | H11 | sing | 1.08Å | 1.08Å | |
| C15 | H14 | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C13 | O1 | doub | 1.21Å | 1.43Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C13 | C10 | C09 | 120.5° | 120.0° |
| C13 | C10 | C11 | 119.1° | 120.0° |
| C10 | C13 | H11 | 126.0° | 120.0° |
| C10 | C13 | O1 | 108.0° | 120.0° |
| C09 | C10 | C11 | 120.4° | 120.0° |
| C10 | C09 | C08 | 120.5° | 119.9° |
| C10 | C09 | H8 | 119.7° | 120.0° |
| C10 | C11 | C12 | 119.5° | 120.0° |
| C10 | C11 | H9 | 120.2° | 120.0° |
| C09 | C08 | C07 | 119.1° | 120.0° |
| C09 | C08 | H7 | 120.5° | 119.9° |
| C08 | C09 | H8 | 119.8° | 120.0° |
| C11 | C12 | C07 | 120.0° | 120.0° |
| C12 | C11 | H9 | 120.3° | 120.0° |
| C11 | C12 | H10 | 120.0° | 120.0° |
| C08 | C07 | C12 | 120.4° | 120.1° |
| C08 | C07 | C06 | 120.1° | 120.0° |
| C07 | C08 | H7 | 120.4° | 120.0° |
| C12 | C07 | C06 | 119.4° | 120.0° |
| C07 | C12 | H10 | 120.0° | 119.9° |
| C07 | C06 | N05 | 114.8° | 120.0° |
| C07 | C06 | O14 | 121.4° | 120.0° |
| N05 | C15 | C03 | 85.1° | 86.2° |
| C15 | N05 | C06 | 134.9° | 134.5° |
| C15 | N05 | C04 | 85.3° | 91.0° |
| N05 | C15 | H14 | 115.2° | 113.8° |
| N05 | C15 | H15 | 115.2° | 113.8° |
| C15 | C03 | C04 | 85.8° | 86.3° |
| C15 | C03 | O02 | 111.2° | 113.8° |
| C15 | C03 | H4 | 113.9° | 113.9° |
| C03 | C15 | H14 | 115.2° | 113.8° |
| C03 | C15 | H15 | 115.2° | 113.7° |
| N05 | C06 | O14 | 123.7° | 120.0° |
| C06 | N05 | C04 | 139.7° | 134.5° |
| N05 | C04 | C03 | 84.8° | 86.2° |
| N05 | C04 | H5 | 115.2° | 113.8° |
| N05 | C04 | H6 | 115.2° | 113.9° |
| C04 | C03 | O02 | 114.1° | 113.8° |
| C04 | C03 | H4 | 113.5° | 113.7° |
| C03 | C04 | H5 | 115.3° | 113.8° |
| C03 | C04 | H6 | 115.3° | 113.8° |
| C03 | O02 | C01 | 116.5° | 114.0° |
| O02 | C03 | H4 | 115.0° | 112.9° |
| O02 | C01 | H1 | 109.5° | 109.4° |
| O02 | C01 | H2 | 109.5° | 109.4° |
| O02 | C01 | H3 | 109.5° | 109.5° |
| H1 | C01 | H2 | 109.4° | 109.5° |
| H1 | C01 | H3 | 109.5° | 109.5° |
| H2 | C01 | H3 | 109.5° | 109.5° |
| H5 | C04 | H6 | 109.4° | 112.9° |
| H11 | C13 | O1 | 126.0° | 120.0° |
| H14 | C15 | H15 | 109.5° | 113.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C13 | C10 | C09 | C11 | 179.3° | 180.0° |
| C13 | C10 | C09 | C08 | 179.8° | 180.0° |
| C13 | C10 | C11 | C12 | 179.9° | 179.8° |
| C13 | C10 | C09 | H8 | 0.2° | 0.0° |
| C13 | C10 | C11 | H9 | 0.1° | 0.0° |
| C10 | C13 | H11 | O1 | 180.0° | 179.9° |
| C10 | C09 | C08 | H8 | 180.0° | 180.0° |
| C09 | C10 | C11 | C12 | 0.8° | 0.2° |
| C10 | C09 | C08 | C07 | 0.5° | 0.0° |
| C10 | C09 | C08 | H7 | 179.5° | 180.0° |
| C09 | C10 | C11 | H9 | 179.2° | 180.0° |
| C09 | C10 | C13 | H11 | 134.1° | 180.0° |
| C09 | C10 | C13 | O1 | 45.9° | 0.0° |
| C11 | C10 | C09 | C08 | 0.5° | 0.0° |
| C10 | C11 | C12 | H9 | 180.0° | 179.8° |
| C10 | C11 | C12 | C07 | 1.1° | 0.5° |
| C11 | C10 | C09 | H8 | 179.5° | 180.0° |
| C10 | C11 | C12 | H10 | 178.9° | 180.0° |
| C11 | C10 | C13 | H11 | 45.2° | 0.0° |
| C11 | C10 | C13 | O1 | 134.8° | 180.0° |
| C09 | C08 | C07 | H7 | 180.0° | 179.9° |
| C09 | C08 | C07 | C12 | 0.8° | 0.3° |
| C09 | C08 | C07 | C06 | 179.0° | 180.0° |
| C11 | C12 | C07 | C08 | 1.1° | 0.5° |
| C11 | C12 | C07 | H10 | 180.0° | 179.5° |
| C11 | C12 | C07 | C06 | 179.3° | 179.8° |
| C08 | C07 | C12 | C06 | 178.2° | 179.7° |
| C08 | C07 | C06 | N05 | 124.4° | 6.9° |
| C08 | C07 | C06 | O14 | 53.5° | 173.1° |
| C07 | C08 | C09 | H8 | 179.5° | 180.0° |
| C08 | C07 | C12 | H10 | 178.9° | 180.0° |
| C12 | C07 | C06 | N05 | 53.8° | 172.8° |
| C12 | C07 | C06 | O14 | 128.3° | 7.1° |
| C12 | C07 | C08 | H7 | 179.2° | 179.8° |
| C07 | C12 | C11 | H9 | 178.9° | 179.7° |
| C07 | C06 | N05 | C15 | 2.3° | 174.5° |
| C07 | C06 | N05 | O14 | 177.8° | 179.9° |
| C07 | C06 | N05 | C04 | 178.2° | 5.6° |
| C06 | C07 | C08 | H7 | 1.0° | 0.0° |
| C06 | C07 | C12 | H10 | 0.7° | 0.2° |
| N05 | C15 | C03 | H14 | 115.6° | 114.3° |
| N05 | C15 | C03 | H15 | 115.6° | 114.3° |
| C15 | N05 | C06 | C04 | 175.9° | 179.9° |
| C15 | N05 | C06 | O14 | 179.8° | 5.6° |
| N05 | C15 | C03 | C04 | 32.0° | 23.6° |
| N05 | C15 | C03 | O02 | 82.2° | 137.9° |
| N05 | C15 | C03 | H4 | 145.9° | 90.7° |
| C15 | N05 | C04 | H5 | 83.8° | 89.7° |
| C15 | N05 | C04 | H6 | 147.3° | 139.0° |
| N05 | C15 | H14 | H15 | 131.6° | 131.8° |
| C03 | C15 | N05 | C06 | 145.0° | 155.3° |
| C15 | C03 | C04 | O02 | 111.4° | 114.4° |
| C15 | C03 | C04 | H4 | 114.3° | 114.5° |
| C15 | C03 | O02 | H4 | 131.4° | 131.8° |
| C15 | C03 | O02 | C01 | 40.6° | 113.3° |
| C15 | C03 | C04 | H5 | 83.1° | 90.7° |
| C15 | C03 | C04 | H6 | 147.8° | 138.0° |
| C03 | C15 | H14 | H15 | 131.7° | 131.7° |
| C06 | N05 | C04 | C03 | 145.3° | 155.4° |
| C06 | N05 | C04 | H5 | 99.2° | 90.3° |
| C06 | N05 | C04 | H6 | 29.8° | 41.0° |
| C06 | N05 | C15 | H14 | 29.4° | 41.1° |
| C06 | N05 | C15 | H15 | 99.4° | 90.4° |
| O14 | C06 | N05 | C04 | 4.0° | 174.3° |
| N05 | C04 | C03 | H5 | 115.5° | 114.3° |
| N05 | C04 | C03 | H6 | 115.5° | 114.5° |
| N05 | C04 | C03 | O02 | 79.0° | 138.0° |
| N05 | C04 | C03 | H4 | 146.7° | 90.9° |
| N05 | C04 | H5 | H6 | 131.8° | 131.8° |
| C04 | N05 | C15 | H14 | 147.9° | 138.9° |
| C04 | N05 | C15 | H15 | 83.2° | 89.7° |
| C04 | C03 | O02 | H4 | 133.6° | 131.5° |
| C04 | C03 | O02 | C01 | 135.7° | 150.0° |
| C03 | C04 | H5 | H6 | 131.8° | 131.7° |
| C04 | C03 | C15 | H14 | 147.5° | 137.9° |
| C04 | C03 | C15 | H15 | 83.6° | 90.7° |
| C03 | O02 | C01 | H1 | 180.0° | 180.0° |
| C03 | O02 | C01 | H2 | 60.0° | 60.0° |
| C03 | O02 | C01 | H3 | 60.0° | 60.0° |
| O02 | C03 | C04 | H5 | 165.5° | 23.6° |
| O02 | C03 | C04 | H6 | 36.5° | 107.6° |
| O02 | C03 | C15 | H14 | 33.3° | 107.7° |
| O02 | C03 | C15 | H15 | 162.2° | 23.6° |
| O02 | C01 | H1 | H2 | 120.0° | 120.0° |
| O02 | C01 | H1 | H3 | 120.0° | 120.0° |
| O02 | C01 | H2 | H3 | 120.0° | 120.0° |
| C01 | O02 | C03 | H4 | 90.7° | 18.4° |
| H1 | C01 | H2 | H3 | 120.0° | 120.0° |
| H4 | C03 | C04 | H5 | 31.2° | 154.8° |
| H4 | C03 | C04 | H6 | 97.8° | 23.5° |
| H4 | C03 | C15 | H14 | 98.6° | 23.6° |
| H4 | C03 | C15 | H15 | 30.3° | 155.0° |
| H7 | C08 | C09 | H8 | 0.5° | 0.0° |
| H9 | C11 | C12 | H10 | 1.1° | 0.2° |
