GQV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | N | sing | 1.47Å | 1.48Å | |
| O1 | C5 | doub | 1.22Å | 1.25Å | |
| N | C5 | sing | 1.35Å | 1.43Å | |
| N | C1 | sing | 1.36Å | 1.39Å | |
| C5 | C4 | sing | 1.41Å | 1.50Å | |
| C1 | C2 | doub | 1.35Å | 1.35Å | |
| C2 | C3 | sing | 1.40Å | 1.42Å | |
| C4 | O | sing | 1.36Å | 1.36Å | |
| C4 | C3 | doub | 1.37Å | 1.36Å | |
| C | H1 | sing | 1.09Å | 1.10Å | |
| C | H2 | sing | 1.09Å | 1.10Å | |
| C | H3 | sing | 1.09Å | 1.10Å | |
| O | H4 | sing | 0.97Å | 0.95Å | |
| C3 | H5 | sing | 1.08Å | 1.08Å | |
| C2 | H6 | sing | 1.08Å | 1.08Å | |
| C1 | H7 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C | N | C5 | 120.0° | 119.6° |
| C | N | C1 | 119.0° | 119.6° |
| N | C | H1 | 109.5° | 109.5° |
| N | C | H2 | 109.4° | 109.4° |
| N | C | H3 | 109.5° | 109.5° |
| O1 | C5 | N | 119.5° | 120.0° |
| O1 | C5 | C4 | 125.3° | 120.1° |
| C5 | N | C1 | 121.0° | 120.8° |
| N | C5 | C4 | 115.2° | 119.9° |
| N | C1 | C2 | 121.4° | 120.8° |
| N | C1 | H7 | 119.3° | 119.6° |
| C5 | C4 | O | 122.8° | 120.3° |
| C5 | C4 | C3 | 121.7° | 119.3° |
| C1 | C2 | C3 | 121.9° | 120.0° |
| C1 | C2 | H6 | 119.0° | 120.0° |
| C2 | C1 | H7 | 119.3° | 119.6° |
| C2 | C3 | C4 | 118.7° | 119.3° |
| C2 | C3 | H5 | 120.7° | 120.3° |
| C3 | C2 | H6 | 119.1° | 120.0° |
| O | C4 | C3 | 115.5° | 120.4° |
| C4 | O | H4 | 109.5° | 114.0° |
| C4 | C3 | H5 | 120.6° | 120.4° |
| H1 | C | H2 | 109.5° | 109.5° |
| H1 | C | H3 | 109.5° | 109.5° |
| H2 | C | H3 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C | N | C5 | O1 | 0.8° | 0.1° |
| C | N | C5 | C1 | 179.4° | 180.0° |
| C | N | C5 | C4 | 179.7° | 180.0° |
| C | N | C1 | C2 | 179.4° | 179.7° |
| N | C | H1 | H2 | 120.0° | 120.0° |
| N | C | H1 | H3 | 120.0° | 120.0° |
| N | C | H2 | H3 | 120.0° | 120.0° |
| C | N | C1 | H7 | 0.7° | 0.1° |
| O1 | C5 | N | C4 | 178.9° | 179.9° |
| O1 | C5 | N | C1 | 178.6° | 180.0° |
| O1 | C5 | C4 | O | 4.2° | 0.1° |
| O1 | C5 | C4 | C3 | 177.8° | 179.8° |
| C5 | N | C1 | C2 | 0.0° | 0.3° |
| N | C5 | C4 | O | 176.9° | 180.0° |
| N | C5 | C4 | C3 | 1.1° | 0.3° |
| C5 | N | C | H1 | 180.0° | 90.0° |
| C5 | N | C | H2 | 60.0° | 150.0° |
| C5 | N | C | H3 | 60.0° | 30.0° |
| C5 | N | C1 | H7 | 180.0° | 180.0° |
| C1 | N | C5 | C4 | 0.3° | 0.0° |
| N | C1 | C2 | H7 | 180.0° | 179.7° |
| N | C1 | C2 | C3 | 0.3° | 0.3° |
| C1 | N | C | H1 | 0.6° | 90.0° |
| C1 | N | C | H2 | 120.6° | 30.0° |
| C1 | N | C | H3 | 119.4° | 150.0° |
| N | C1 | C2 | H6 | 179.7° | 179.8° |
| C5 | C4 | C3 | C2 | 1.4° | 0.3° |
| C5 | C4 | O | C3 | 178.2° | 179.7° |
| C5 | C4 | O | H4 | 1.8° | 179.7° |
| C5 | C4 | C3 | H5 | 178.6° | 179.7° |
| C1 | C2 | C3 | H6 | 180.0° | 179.9° |
| C1 | C2 | C3 | C4 | 1.0° | 0.1° |
| C1 | C2 | C3 | H5 | 179.0° | 179.9° |
| C2 | C3 | C4 | O | 176.8° | 179.9° |
| C2 | C3 | C4 | H5 | 180.0° | 180.0° |
| C3 | C2 | C1 | H7 | 179.7° | 179.9° |
| O | C4 | C3 | H5 | 3.2° | 0.1° |
| C3 | C4 | O | H4 | 180.0° | 0.0° |
| C4 | C3 | C2 | H6 | 179.0° | 179.9° |
| H1 | C | H2 | H3 | 120.0° | 120.0° |
| H5 | C3 | C2 | H6 | 1.0° | 0.1° |
| H6 | C2 | C1 | H7 | 0.3° | 0.1° |
