UV9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | C1 | sing | 1.53Å | 1.52Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| C1 | C8 | sing | 1.53Å | 1.53Å | |
| C1 | C6 | sing | 1.53Å | 1.53Å | |
| C3 | C4 | sing | 1.53Å | 1.53Å | |
| C6 | C5 | sing | 1.53Å | 1.52Å | |
| C4 | N1 | sing | 1.47Å | 1.54Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C4 | C7 | sing | 1.51Å | 1.55Å | |
| C7 | O | doub | 1.21Å | 1.22Å | |
| C7 | N | sing | 1.35Å | 1.35Å | |
| N1 | H1 | sing | 1.01Å | 1.00Å | |
| N1 | H2 | sing | 1.01Å | 1.00Å | |
| C8 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C5 | H7 | sing | 1.09Å | 1.10Å | |
| C5 | H8 | sing | 1.09Å | 1.10Å | |
| C6 | H9 | sing | 1.09Å | 1.10Å | |
| C6 | H10 | sing | 1.09Å | 1.10Å | |
| C3 | H11 | sing | 1.09Å | 1.10Å | |
| C3 | H12 | sing | 1.09Å | 1.10Å | |
| C2 | H13 | sing | 1.09Å | 1.10Å | |
| C2 | H14 | sing | 1.09Å | 1.10Å | |
| N | H15 | sing | 0.97Å | 1.00Å | |
| N | H16 | sing | 0.97Å | 1.00Å | |
| C | H17 | sing | 1.09Å | 1.10Å | |
| C | H18 | sing | 1.09Å | 1.10Å | |
| C | H19 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C | C1 | C2 | 111.6° | 109.5° |
| C | C1 | C8 | 108.1° | 109.5° |
| C | C1 | C6 | 110.8° | 109.5° |
| C1 | C | H17 | 109.5° | 109.5° |
| C1 | C | H18 | 109.5° | 109.5° |
| C1 | C | H19 | 109.5° | 109.5° |
| C1 | C2 | C3 | 111.2° | 109.5° |
| C2 | C1 | C8 | 108.1° | 109.5° |
| C2 | C1 | C6 | 110.1° | 109.5° |
| C1 | C2 | H13 | 109.0° | 109.5° |
| C1 | C2 | H14 | 109.0° | 109.5° |
| C2 | C3 | C4 | 111.3° | 109.5° |
| C2 | C3 | H11 | 109.0° | 109.5° |
| C2 | C3 | H12 | 109.0° | 109.5° |
| C3 | C2 | H13 | 109.0° | 109.5° |
| C3 | C2 | H14 | 109.0° | 109.4° |
| C8 | C1 | C6 | 108.1° | 109.5° |
| C1 | C8 | H4 | 109.5° | 109.5° |
| C1 | C8 | H5 | 109.5° | 109.5° |
| C1 | C8 | H6 | 109.5° | 109.5° |
| C1 | C6 | C5 | 111.3° | 109.5° |
| C1 | C6 | H9 | 109.0° | 109.5° |
| C1 | C6 | H10 | 109.0° | 109.5° |
| C3 | C4 | N1 | 108.5° | 109.5° |
| C3 | C4 | C5 | 111.2° | 109.4° |
| C3 | C4 | C7 | 112.4° | 109.5° |
| C4 | C3 | H11 | 109.0° | 109.4° |
| C4 | C3 | H12 | 109.0° | 109.4° |
| C6 | C5 | C4 | 111.5° | 109.5° |
| C6 | C5 | H7 | 109.0° | 109.5° |
| C6 | C5 | H8 | 108.9° | 109.5° |
| C5 | C6 | H9 | 109.0° | 109.5° |
| C5 | C6 | H10 | 109.1° | 109.4° |
| N1 | C4 | C5 | 109.1° | 109.5° |
| N1 | C4 | C7 | 104.8° | 109.5° |
| C4 | N1 | H1 | 109.5° | 111.1° |
| C4 | N1 | H2 | 109.4° | 111.1° |
| C5 | C4 | C7 | 110.5° | 109.5° |
| C4 | C5 | H7 | 108.9° | 109.4° |
| C4 | C5 | H8 | 109.0° | 109.5° |
| C4 | C7 | O | 118.8° | 120.0° |
| C4 | C7 | N | 119.0° | 120.0° |
| O | C7 | N | 122.2° | 120.0° |
| C7 | N | H15 | 120.0° | 120.0° |
| C7 | N | H16 | 120.0° | 120.0° |
| H1 | N1 | H2 | 109.5° | 111.0° |
| H4 | C8 | H5 | 109.5° | 109.4° |
| H4 | C8 | H6 | 109.5° | 109.5° |
| H5 | C8 | H6 | 109.5° | 109.5° |
| H7 | C5 | H8 | 109.5° | 109.5° |
| H9 | C6 | H10 | 109.4° | 109.5° |
| H11 | C3 | H12 | 109.5° | 109.5° |
| H13 | C2 | H14 | 109.5° | 109.4° |
| H15 | N | H16 | 120.0° | 120.1° |
| H17 | C | H18 | 109.5° | 109.5° |
| H17 | C | H19 | 109.4° | 109.4° |
| H18 | C | H19 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C | C1 | C2 | C8 | 118.8° | 120.0° |
| C | C1 | C2 | C6 | 123.4° | 120.0° |
| C | C1 | C2 | C3 | 179.4° | 180.0° |
| C | C1 | C8 | C6 | 119.9° | 120.0° |
| C | C1 | C6 | C5 | 179.1° | 180.0° |
| C | C1 | C8 | H4 | 180.0° | 59.9° |
| C | C1 | C8 | H5 | 60.0° | 60.0° |
| C | C1 | C8 | H6 | 60.0° | 180.0° |
| C | C1 | C6 | H9 | 60.7° | 60.0° |
| C | C1 | C6 | H10 | 58.8° | 60.0° |
| C | C1 | C2 | H13 | 59.1° | 60.0° |
| C | C1 | C2 | H14 | 60.4° | 60.0° |
| C1 | C | H17 | H18 | 120.0° | 120.1° |
| C1 | C | H17 | H19 | 120.0° | 120.0° |
| C1 | C | H18 | H19 | 120.0° | 120.0° |
| C1 | C2 | C3 | H13 | 120.3° | 120.0° |
| C1 | C2 | C3 | H14 | 120.3° | 120.0° |
| C2 | C1 | C8 | C6 | 119.1° | 120.0° |
| C1 | C2 | C3 | C4 | 56.1° | 60.0° |
| C2 | C1 | C6 | C5 | 57.1° | 60.0° |
| C2 | C1 | C8 | H4 | 59.1° | 180.0° |
| C2 | C1 | C8 | H5 | 179.1° | 60.0° |
| C2 | C1 | C8 | H6 | 60.9° | 60.0° |
| C2 | C1 | C6 | H9 | 63.2° | 60.0° |
| C2 | C1 | C6 | H10 | 177.3° | 180.0° |
| C1 | C2 | C3 | H11 | 64.2° | 180.0° |
| C1 | C2 | C3 | H12 | 176.3° | 60.0° |
| C1 | C2 | H13 | H14 | 119.2° | 120.0° |
| C2 | C1 | C | H17 | 180.0° | 180.0° |
| C2 | C1 | C | H18 | 60.0° | 60.0° |
| C2 | C1 | C | H19 | 60.0° | 60.0° |
| C3 | C2 | C1 | C8 | 60.6° | 60.0° |
| C3 | C2 | C1 | C6 | 57.2° | 60.0° |
| C2 | C3 | C4 | H11 | 120.3° | 120.0° |
| C2 | C3 | C4 | H12 | 120.3° | 120.0° |
| C2 | C3 | C4 | N1 | 65.9° | 60.0° |
| C2 | C3 | C4 | C5 | 54.1° | 60.0° |
| C2 | C3 | C4 | C7 | 178.6° | 180.0° |
| C2 | C3 | H11 | H12 | 119.2° | 120.1° |
| C3 | C2 | H13 | H14 | 119.2° | 119.9° |
| C8 | C1 | C6 | C5 | 60.8° | 60.0° |
| C1 | C8 | H4 | H5 | 120.0° | 120.0° |
| C1 | C8 | H4 | H6 | 120.0° | 120.1° |
| C1 | C8 | H5 | H6 | 120.0° | 120.0° |
| C8 | C1 | C6 | H9 | 178.9° | 180.0° |
| C8 | C1 | C6 | H10 | 59.5° | 60.0° |
| C8 | C1 | C2 | H13 | 59.7° | 60.0° |
| C8 | C1 | C2 | H14 | 179.1° | 180.0° |
| C8 | C1 | C | H17 | 61.3° | 59.9° |
| C8 | C1 | C | H18 | 178.7° | 180.0° |
| C8 | C1 | C | H19 | 58.7° | 60.0° |
| C1 | C6 | C5 | H9 | 120.3° | 120.0° |
| C1 | C6 | C5 | H10 | 120.3° | 120.0° |
| C1 | C6 | C5 | C4 | 55.9° | 60.0° |
| C6 | C1 | C8 | H4 | 60.0° | 60.0° |
| C6 | C1 | C8 | H5 | 60.0° | 180.0° |
| C6 | C1 | C8 | H6 | 180.0° | 60.0° |
| C1 | C6 | C5 | H7 | 176.2° | 179.9° |
| C1 | C6 | C5 | H8 | 64.4° | 60.0° |
| C1 | C6 | H9 | H10 | 119.2° | 120.1° |
| C6 | C1 | C2 | H13 | 177.5° | 180.0° |
| C6 | C1 | C2 | H14 | 63.0° | 60.0° |
| C6 | C1 | C | H17 | 57.0° | 60.0° |
| C6 | C1 | C | H18 | 63.0° | 60.0° |
| C6 | C1 | C | H19 | 177.0° | 180.0° |
| C3 | C4 | C5 | C6 | 54.1° | 60.0° |
| C3 | C4 | N1 | C5 | 121.4° | 120.0° |
| C3 | C4 | N1 | C7 | 120.3° | 120.0° |
| C3 | C4 | C5 | C7 | 125.6° | 120.0° |
| C3 | C4 | C7 | O | 83.7° | 95.0° |
| C3 | C4 | C7 | N | 96.9° | 85.0° |
| C3 | C4 | N1 | H1 | 180.0° | 60.0° |
| C3 | C4 | N1 | H2 | 60.0° | 64.0° |
| C3 | C4 | C5 | H7 | 174.4° | 180.0° |
| C3 | C4 | C5 | H8 | 66.2° | 60.1° |
| C4 | C3 | H11 | H12 | 119.2° | 119.9° |
| C4 | C3 | C2 | H13 | 176.3° | 180.0° |
| C4 | C3 | C2 | H14 | 64.2° | 60.0° |
| C6 | C5 | C4 | N1 | 65.6° | 59.9° |
| C6 | C5 | C4 | H7 | 120.3° | 119.9° |
| C6 | C5 | C4 | H8 | 120.3° | 120.1° |
| C6 | C5 | C4 | C7 | 179.6° | 180.0° |
| C6 | C5 | H7 | H8 | 119.0° | 120.1° |
| C5 | C6 | H9 | H10 | 119.2° | 120.0° |
| N1 | C4 | C5 | C7 | 114.7° | 120.0° |
| N1 | C4 | C7 | O | 33.9° | 145.0° |
| N1 | C4 | C7 | N | 145.5° | 35.0° |
| C4 | N1 | H1 | H2 | 120.0° | 124.0° |
| N1 | C4 | C5 | H7 | 54.7° | 60.0° |
| N1 | C4 | C5 | H8 | 174.1° | 180.0° |
| N1 | C4 | C3 | H11 | 173.8° | 60.0° |
| N1 | C4 | C3 | H12 | 54.3° | 180.0° |
| C5 | C4 | C7 | O | 151.3° | 25.0° |
| C5 | C4 | C7 | N | 28.1° | 155.0° |
| C5 | C4 | N1 | H1 | 58.7° | 180.0° |
| C5 | C4 | N1 | H2 | 178.7° | 56.0° |
| C4 | C5 | H7 | H8 | 119.1° | 120.0° |
| C4 | C5 | C6 | H9 | 64.4° | 60.0° |
| C4 | C5 | C6 | H10 | 176.2° | 180.0° |
| C5 | C4 | C3 | H11 | 66.2° | 180.0° |
| C5 | C4 | C3 | H12 | 174.4° | 60.0° |
| C4 | C7 | O | N | 179.4° | 179.9° |
| C7 | C4 | N1 | H1 | 59.7° | 60.0° |
| C7 | C4 | N1 | H2 | 60.3° | 176.0° |
| C7 | C4 | C5 | H7 | 60.0° | 60.0° |
| C7 | C4 | C5 | H8 | 59.3° | 60.0° |
| C7 | C4 | C3 | H11 | 58.4° | 60.0° |
| C7 | C4 | C3 | H12 | 61.1° | 60.0° |
| C4 | C7 | N | H15 | 179.4° | 180.0° |
| C4 | C7 | N | H16 | 0.6° | 0.0° |
| O | C7 | N | H15 | 0.0° | 0.0° |
| O | C7 | N | H16 | 180.0° | 180.0° |
| C7 | N | H15 | H16 | 180.0° | 180.0° |
| H4 | C8 | H5 | H6 | 120.0° | 120.0° |
| H7 | C5 | C6 | H9 | 56.0° | 59.9° |
| H7 | C5 | C6 | H10 | 63.5° | 60.1° |
| H8 | C5 | C6 | H9 | 175.3° | 180.0° |
| H8 | C5 | C6 | H10 | 55.9° | 60.0° |
| H11 | C3 | C2 | H13 | 56.1° | 60.0° |
| H11 | C3 | C2 | H14 | 175.6° | 59.9° |
| H12 | C3 | C2 | H13 | 63.4° | 60.0° |
| H12 | C3 | C2 | H14 | 56.1° | 180.0° |
| H17 | C | H18 | H19 | 120.0° | 119.9° |
