K7L
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C1 | sing | 1.35Å | 1.35Å | |
| C1 | C2 | sing | 1.40Å | 1.40Å | Aromatic |
| C2 | C3 | doub | 1.36Å | 1.39Å | Aromatic |
| C3 | O2 | sing | 1.35Å | 1.36Å | |
| C3 | N1 | sing | 1.37Å | 1.38Å | Aromatic |
| N1 | C4 | sing | 1.37Å | 1.38Å | Aromatic |
| C4 | C5 | doub | 1.35Å | 1.36Å | Aromatic |
| C5 | N2 | sing | 1.34Å | 1.37Å | Aromatic |
| N2 | C6 | doub | 1.33Å | 1.33Å | Aromatic |
| C6 | N3 | sing | 1.34Å | 1.34Å | Aromatic |
| C1 | N3 | doub | 1.32Å | 1.31Å | Aromatic |
| N1 | C6 | sing | 1.37Å | 1.40Å | Aromatic |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| O1 | H1 | sing | 0.97Å | 0.95Å | |
| O2 | H3 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C1 | C2 | 119.6° | 119.8° |
| O1 | C1 | N3 | 117.1° | 119.8° |
| C1 | O1 | H1 | 109.5° | 114.0° |
| C1 | C2 | C3 | 118.9° | 119.2° |
| C2 | C1 | N3 | 123.3° | 120.3° |
| C1 | C2 | H2 | 120.5° | 120.4° |
| C2 | C3 | O2 | 123.1° | 120.5° |
| C2 | C3 | N1 | 117.7° | 119.0° |
| C3 | C2 | H2 | 120.5° | 120.4° |
| O2 | C3 | N1 | 119.2° | 120.5° |
| C3 | O2 | H3 | 109.5° | 114.0° |
| C3 | N1 | C4 | 133.4° | 132.7° |
| C3 | N1 | C6 | 119.5° | 120.2° |
| N1 | C4 | C5 | 105.7° | 107.0° |
| C4 | N1 | C6 | 107.1° | 107.1° |
| N1 | C4 | H4 | 127.2° | 126.5° |
| C4 | C5 | N2 | 111.5° | 108.7° |
| C5 | C4 | H4 | 127.2° | 126.5° |
| C4 | C5 | H5 | 124.2° | 125.6° |
| C5 | N2 | C6 | 106.0° | 109.3° |
| N2 | C5 | H5 | 124.2° | 125.7° |
| N2 | C6 | N3 | 128.4° | 131.9° |
| N2 | C6 | N1 | 109.7° | 107.8° |
| C6 | N3 | C1 | 118.6° | 120.9° |
| N3 | C6 | N1 | 121.9° | 120.3° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | C2 | N3 | 179.8° | 179.9° |
| O1 | C1 | C2 | C3 | 180.0° | 180.0° |
| O1 | C1 | N3 | C6 | 179.8° | 179.9° |
| O1 | C1 | C2 | H2 | 0.1° | 0.2° |
| C1 | C2 | C3 | H2 | 180.0° | 179.8° |
| C1 | C2 | C3 | O2 | 179.6° | 179.9° |
| C1 | C2 | C3 | N1 | 0.2° | 0.1° |
| C2 | C1 | N3 | C6 | 0.0° | 0.2° |
| C2 | C1 | O1 | H1 | 179.8° | 180.0° |
| C2 | C3 | O2 | N1 | 179.8° | 180.0° |
| C2 | C3 | N1 | C4 | 180.0° | 180.0° |
| C3 | C2 | C1 | N3 | 0.2° | 0.1° |
| C2 | C3 | N1 | C6 | 0.0° | 0.3° |
| C2 | C3 | O2 | H3 | 180.0° | 0.1° |
| O2 | C3 | N1 | C4 | 0.2° | 0.0° |
| O2 | C3 | N1 | C6 | 179.8° | 179.7° |
| O2 | C3 | C2 | H2 | 0.4° | 0.3° |
| C3 | N1 | C4 | C6 | 180.0° | 179.7° |
| C3 | N1 | C4 | C5 | 179.8° | 179.7° |
| C3 | N1 | C6 | N2 | 179.8° | 179.7° |
| C3 | N1 | C6 | N3 | 0.2° | 0.2° |
| C3 | N1 | C4 | H4 | 0.2° | 0.3° |
| N1 | C3 | C2 | H2 | 179.7° | 179.7° |
| N1 | C3 | O2 | H3 | 0.2° | 179.9° |
| N1 | C4 | C5 | H4 | 180.0° | 180.0° |
| N1 | C4 | C5 | N2 | 0.0° | 0.1° |
| C4 | N1 | C6 | N2 | 0.2° | 0.0° |
| C4 | N1 | C6 | N3 | 179.8° | 180.0° |
| N1 | C4 | C5 | H5 | 180.0° | 179.9° |
| C4 | C5 | N2 | H5 | 180.0° | 179.9° |
| C4 | C5 | N2 | C6 | 0.2° | 0.1° |
| C5 | C4 | N1 | C6 | 0.1° | 0.0° |
| C5 | N2 | C6 | N3 | 179.8° | 179.9° |
| C5 | N2 | C6 | N1 | 0.2° | 0.0° |
| N2 | C5 | C4 | H4 | 180.0° | 180.0° |
| N2 | C6 | N3 | N1 | 179.5° | 180.0° |
| N2 | C6 | N3 | C1 | 179.7° | 180.0° |
| C6 | N2 | C5 | H5 | 179.8° | 179.9° |
| C1 | N3 | C6 | N1 | 0.2° | 0.0° |
| N3 | C1 | C2 | H2 | 179.7° | 180.0° |
| N3 | C1 | O1 | H1 | 0.0° | 0.1° |
| C6 | N1 | C4 | H4 | 179.9° | 180.0° |
| H4 | C4 | C5 | H5 | 0.0° | 0.1° |






