V8T
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C10 | C8 | sing | 1.53Å | 1.48Å | |
| C8 | C9 | sing | 1.53Å | 1.45Å | |
| C8 | O | sing | 1.43Å | 1.43Å | |
| O | C5 | sing | 1.36Å | 1.37Å | |
| C6 | C5 | doub | 1.39Å | 1.38Å | Aromatic |
| C6 | C7 | sing | 1.38Å | 1.38Å | Aromatic |
| C5 | C4 | sing | 1.39Å | 1.38Å | Aromatic |
| C7 | C2 | doub | 1.38Å | 1.38Å | Aromatic |
| C4 | C3 | doub | 1.38Å | 1.38Å | Aromatic |
| C2 | C3 | sing | 1.38Å | 1.38Å | Aromatic |
| C2 | C1 | sing | 1.51Å | 1.51Å | |
| N | C1 | sing | 1.47Å | 1.50Å | |
| C1 | C | sing | 1.53Å | 1.51Å | |
| C7 | H1 | sing | 1.08Å | 1.08Å | |
| C8 | H2 | sing | 1.09Å | 1.10Å | |
| C9 | H3 | sing | 1.09Å | 1.10Å | |
| C9 | H4 | sing | 1.09Å | 1.10Å | |
| C9 | H5 | sing | 1.09Å | 1.10Å | |
| C1 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H7 | sing | 1.08Å | 1.08Å | |
| C4 | H8 | sing | 1.08Å | 1.08Å | |
| C3 | H9 | sing | 1.08Å | 1.08Å | |
| N | H10 | sing | 1.01Å | 1.00Å | |
| N | H11 | sing | 1.01Å | 1.00Å | |
| C | H13 | sing | 1.09Å | 1.10Å | |
| C | H14 | sing | 1.09Å | 1.10Å | |
| C | H15 | sing | 1.09Å | 1.10Å | |
| C10 | H16 | sing | 1.09Å | 1.10Å | |
| C10 | H17 | sing | 1.09Å | 1.10Å | |
| C10 | H18 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C10 | C8 | C9 | 113.0° | 109.5° |
| C10 | C8 | O | 104.5° | 109.5° |
| C10 | C8 | H2 | 109.9° | 109.5° |
| C8 | C10 | H16 | 109.5° | 109.4° |
| C8 | C10 | H17 | 109.5° | 109.5° |
| C8 | C10 | H18 | 109.5° | 109.5° |
| C9 | C8 | O | 108.4° | 109.4° |
| C9 | C8 | H2 | 110.2° | 109.5° |
| C8 | C9 | H3 | 109.5° | 109.5° |
| C8 | C9 | H4 | 109.5° | 109.4° |
| C8 | C9 | H5 | 109.5° | 109.5° |
| C8 | O | C5 | 120.4° | 117.0° |
| O | C8 | H2 | 110.6° | 109.4° |
| O | C5 | C6 | 123.8° | 120.1° |
| O | C5 | C4 | 116.0° | 120.1° |
| C5 | C6 | C7 | 119.7° | 119.9° |
| C6 | C5 | C4 | 120.1° | 119.9° |
| C5 | C6 | H7 | 120.2° | 120.0° |
| C6 | C7 | C2 | 121.2° | 120.1° |
| C6 | C7 | H1 | 119.4° | 120.0° |
| C7 | C6 | H7 | 120.1° | 120.0° |
| C5 | C4 | C3 | 119.7° | 120.0° |
| C5 | C4 | H8 | 120.1° | 120.0° |
| C7 | C2 | C3 | 118.1° | 120.1° |
| C7 | C2 | C1 | 121.1° | 119.9° |
| C2 | C7 | H1 | 119.4° | 119.9° |
| C4 | C3 | C2 | 121.2° | 120.1° |
| C3 | C4 | H8 | 120.1° | 120.0° |
| C4 | C3 | H9 | 119.4° | 120.0° |
| C3 | C2 | C1 | 120.8° | 120.0° |
| C2 | C3 | H9 | 119.4° | 120.0° |
| C2 | C1 | N | 111.1° | 109.4° |
| C2 | C1 | C | 113.1° | 109.4° |
| C2 | C1 | H6 | 107.8° | 109.5° |
| N | C1 | C | 109.1° | 109.5° |
| N | C1 | H6 | 107.9° | 109.5° |
| C1 | N | H10 | 109.5° | 111.0° |
| C1 | N | H11 | 109.5° | 111.0° |
| C | C1 | H6 | 107.7° | 109.5° |
| C1 | C | H13 | 109.5° | 109.5° |
| C1 | C | H14 | 109.5° | 109.5° |
| C1 | C | H15 | 109.5° | 109.5° |
| H3 | C9 | H4 | 109.5° | 109.4° |
| H3 | C9 | H5 | 109.4° | 109.5° |
| H4 | C9 | H5 | 109.5° | 109.5° |
| H10 | N | H11 | 109.5° | 111.0° |
| H13 | C | H14 | 109.5° | 109.5° |
| H13 | C | H15 | 109.5° | 109.4° |
| H14 | C | H15 | 109.4° | 109.4° |
| H16 | C10 | H17 | 109.5° | 109.4° |
| H16 | C10 | H18 | 109.5° | 109.5° |
| H17 | C10 | H18 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C10 | C8 | C9 | O | 115.3° | 120.0° |
| C10 | C8 | C9 | H2 | 123.4° | 120.0° |
| C10 | C8 | O | H2 | 118.2° | 120.0° |
| C10 | C8 | O | C5 | 173.6° | 155.3° |
| C10 | C8 | C9 | H3 | 180.0° | 180.0° |
| C10 | C8 | C9 | H4 | 60.0° | 60.0° |
| C10 | C8 | C9 | H5 | 60.0° | 59.9° |
| C8 | C10 | H16 | H17 | 120.0° | 120.0° |
| C8 | C10 | H16 | H18 | 120.0° | 120.0° |
| C8 | C10 | H17 | H18 | 120.0° | 120.1° |
| C9 | C8 | O | H2 | 121.0° | 120.0° |
| C9 | C8 | O | C5 | 65.6° | 84.6° |
| C8 | C9 | H3 | H4 | 120.0° | 120.0° |
| C8 | C9 | H3 | H5 | 120.0° | 120.1° |
| C8 | C9 | H4 | H5 | 120.0° | 120.0° |
| C9 | C8 | C10 | H16 | 180.0° | 60.0° |
| C9 | C8 | C10 | H17 | 60.0° | 180.0° |
| C9 | C8 | C10 | H18 | 60.0° | 60.0° |
| C8 | O | C5 | C6 | 24.4° | 5.1° |
| C8 | O | C5 | C4 | 159.9° | 174.7° |
| O | C8 | C9 | H3 | 64.7° | 60.0° |
| O | C8 | C9 | H4 | 55.3° | 180.0° |
| O | C8 | C9 | H5 | 175.3° | 60.1° |
| O | C8 | C10 | H16 | 62.4° | 180.0° |
| O | C8 | C10 | H17 | 177.6° | 60.0° |
| O | C8 | C10 | H18 | 57.6° | 60.0° |
| O | C5 | C6 | C4 | 175.5° | 179.8° |
| O | C5 | C6 | C7 | 174.5° | 179.7° |
| O | C5 | C4 | C3 | 174.7° | 180.0° |
| C5 | O | C8 | H2 | 55.4° | 35.3° |
| O | C5 | C6 | H7 | 5.5° | 0.2° |
| O | C5 | C4 | H8 | 5.3° | 0.3° |
| C5 | C6 | C7 | H7 | 180.0° | 179.9° |
| C5 | C6 | C7 | C2 | 0.6° | 0.1° |
| C6 | C5 | C4 | C3 | 1.2° | 0.3° |
| C5 | C6 | C7 | H1 | 179.4° | 179.7° |
| C6 | C5 | C4 | H8 | 178.8° | 179.9° |
| C7 | C6 | C5 | C4 | 1.0° | 0.1° |
| C6 | C7 | C2 | H1 | 180.0° | 179.8° |
| C6 | C7 | C2 | C3 | 0.4° | 0.2° |
| C6 | C7 | C2 | C1 | 177.3° | 179.7° |
| C5 | C4 | C3 | H8 | 180.0° | 179.7° |
| C5 | C4 | C3 | C2 | 1.0° | 0.6° |
| C4 | C5 | C6 | H7 | 179.0° | 180.0° |
| C5 | C4 | C3 | H9 | 179.0° | 180.0° |
| C7 | C2 | C3 | C4 | 0.6° | 0.6° |
| C7 | C2 | C3 | C1 | 177.7° | 180.0° |
| C7 | C2 | C1 | N | 65.3° | 140.0° |
| C7 | C2 | C1 | C | 57.7° | 100.0° |
| C7 | C2 | C1 | H6 | 176.7° | 19.9° |
| C2 | C7 | C6 | H7 | 179.4° | 180.0° |
| C7 | C2 | C3 | H9 | 179.4° | 180.0° |
| C4 | C3 | C2 | H9 | 180.0° | 179.4° |
| C4 | C3 | C2 | C1 | 177.2° | 179.4° |
| C3 | C2 | C1 | N | 117.0° | 39.9° |
| C3 | C2 | C1 | C | 120.0° | 80.0° |
| C3 | C2 | C7 | H1 | 179.6° | 180.0° |
| C3 | C2 | C1 | H6 | 1.0° | 160.0° |
| C2 | C3 | C4 | H8 | 179.0° | 179.7° |
| C2 | C1 | N | C | 125.3° | 119.9° |
| C2 | C1 | N | H6 | 117.9° | 120.1° |
| C2 | C1 | C | H6 | 119.0° | 120.0° |
| C1 | C2 | C7 | H1 | 2.6° | 0.1° |
| C1 | C2 | C3 | H9 | 2.9° | 0.1° |
| C2 | C1 | N | H10 | 180.0° | 180.0° |
| C2 | C1 | N | H11 | 60.0° | 56.0° |
| C2 | C1 | C | H13 | 180.0° | 60.1° |
| C2 | C1 | C | H14 | 60.0° | 60.0° |
| C2 | C1 | C | H15 | 60.0° | 180.0° |
| N | C1 | C | H6 | 116.9° | 120.0° |
| C1 | N | H10 | H11 | 120.0° | 124.0° |
| N | C1 | C | H13 | 55.9° | 180.0° |
| N | C1 | C | H14 | 175.9° | 59.9° |
| N | C1 | C | H15 | 64.1° | 60.0° |
| C | C1 | N | H10 | 54.7° | 60.1° |
| C | C1 | N | H11 | 65.4° | 63.9° |
| C1 | C | H13 | H14 | 120.0° | 120.1° |
| C1 | C | H13 | H15 | 120.0° | 120.0° |
| C1 | C | H14 | H15 | 120.0° | 120.0° |
| H1 | C7 | C6 | H7 | 0.6° | 0.2° |
| H2 | C8 | C9 | H3 | 56.5° | 59.9° |
| H2 | C8 | C9 | H4 | 176.6° | 60.0° |
| H2 | C8 | C9 | H5 | 63.4° | 180.0° |
| H2 | C8 | C10 | H16 | 56.4° | 60.0° |
| H2 | C8 | C10 | H17 | 63.7° | 59.9° |
| H2 | C8 | C10 | H18 | 176.4° | 180.0° |
| H3 | C9 | H4 | H5 | 120.0° | 120.0° |
| H6 | C1 | N | H10 | 62.1° | 59.9° |
| H6 | C1 | N | H11 | 177.9° | 176.1° |
| H6 | C1 | C | H13 | 61.0° | 60.0° |
| H6 | C1 | C | H14 | 59.0° | 180.0° |
| H6 | C1 | C | H15 | 179.0° | 60.0° |
| H8 | C4 | C3 | H9 | 1.0° | 0.3° |
| H13 | C | H14 | H15 | 120.0° | 119.9° |
| H16 | C10 | H17 | H18 | 120.0° | 120.0° |
