ZS7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | N | sing | 1.36Å | 1.32Å | |
| N1 | C | doub | 1.32Å | 1.38Å | |
| C1 | N1 | sing | 1.34Å | 1.34Å | |
| O | C1 | doub | 1.22Å | 1.24Å | |
| C1 | C2 | sing | 1.49Å | 1.47Å | |
| C2 | C3 | doub | 1.38Å | 1.38Å | Aromatic |
| C4 | C3 | sing | 1.39Å | 1.38Å | Aromatic |
| C5 | C4 | doub | 1.38Å | 1.39Å | Aromatic |
| C6 | C5 | sing | 1.39Å | 1.39Å | Aromatic |
| C7 | C6 | doub | 1.38Å | 1.39Å | Aromatic |
| C7 | C | sing | 1.48Å | 1.48Å | |
| C2 | C7 | sing | 1.41Å | 1.39Å | Aromatic |
| C5 | H4 | sing | 1.08Å | 1.08Å | |
| C6 | H5 | sing | 1.08Å | 1.08Å | |
| C4 | H3 | sing | 1.08Å | 1.08Å | |
| C3 | H2 | sing | 1.08Å | 1.08Å | |
| N | H | sing | 0.97Å | 1.00Å | |
| N | H1 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N | C | N1 | 124.5° | 125.4° |
| N | C | C7 | 125.7° | 125.5° |
| C | N | H | 120.0° | 120.0° |
| C | N | H1 | 120.0° | 120.0° |
| C | N1 | C1 | 108.5° | 111.6° |
| N1 | C | C7 | 109.8° | 109.1° |
| N1 | C1 | O | 127.1° | 125.9° |
| N1 | C1 | C2 | 109.1° | 108.2° |
| O | C1 | C2 | 123.8° | 125.9° |
| C1 | C2 | C3 | 129.8° | 134.6° |
| C1 | C2 | C7 | 108.2° | 105.4° |
| C2 | C3 | C4 | 117.2° | 119.7° |
| C3 | C2 | C7 | 122.0° | 120.0° |
| C2 | C3 | H2 | 121.4° | 120.1° |
| C3 | C4 | C5 | 121.2° | 120.4° |
| C3 | C4 | H3 | 119.4° | 119.8° |
| C4 | C3 | H2 | 121.4° | 120.2° |
| C4 | C5 | C6 | 121.5° | 120.3° |
| C4 | C5 | H4 | 119.2° | 119.8° |
| C5 | C4 | H3 | 119.4° | 119.8° |
| C5 | C6 | C7 | 117.3° | 119.7° |
| C6 | C5 | H4 | 119.3° | 119.8° |
| C5 | C6 | H5 | 121.4° | 120.1° |
| C6 | C7 | C | 134.9° | 134.5° |
| C6 | C7 | C2 | 120.8° | 119.8° |
| C7 | C6 | H5 | 121.3° | 120.2° |
| C | C7 | C2 | 104.2° | 105.7° |
| H | N | H1 | 120.0° | 120.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N | C | N1 | C7 | 179.8° | 179.9° |
| N | C | N1 | C1 | 178.7° | 179.9° |
| N | C | C7 | C6 | 1.5° | 0.1° |
| N | C | C7 | C2 | 179.0° | 179.9° |
| C | N | H | H1 | 180.0° | 179.9° |
| C | N1 | C1 | O | 179.6° | 180.0° |
| C | N1 | C1 | C2 | 0.9° | 0.0° |
| N1 | C | C7 | C6 | 178.7° | 180.0° |
| N1 | C | C7 | C2 | 0.8° | 0.0° |
| N1 | C | N | H | 0.0° | 0.1° |
| N1 | C | N | H1 | 180.0° | 180.0° |
| N1 | C1 | O | C2 | 178.5° | 180.0° |
| N1 | C1 | C2 | C3 | 178.9° | 180.0° |
| C1 | N1 | C | C7 | 1.1° | 0.0° |
| N1 | C1 | C2 | C7 | 0.4° | 0.0° |
| O | C1 | C2 | C3 | 0.2° | 0.0° |
| O | C1 | C2 | C7 | 179.2° | 180.0° |
| C1 | C2 | C3 | C7 | 179.2° | 180.0° |
| C1 | C2 | C3 | C4 | 179.0° | 180.0° |
| C1 | C2 | C7 | C6 | 179.3° | 180.0° |
| C1 | C2 | C7 | C | 0.3° | 0.0° |
| C1 | C2 | C3 | H2 | 1.0° | 0.1° |
| C2 | C3 | C4 | H2 | 180.0° | 179.8° |
| C2 | C3 | C4 | C5 | 0.4° | 0.1° |
| C3 | C2 | C7 | C6 | 0.0° | 0.0° |
| C3 | C2 | C7 | C | 179.6° | 180.0° |
| C2 | C3 | C4 | H3 | 179.6° | 179.9° |
| C3 | C4 | C5 | H3 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 0.4° | 0.2° |
| C4 | C3 | C2 | C7 | 0.3° | 0.0° |
| C3 | C4 | C5 | H4 | 179.6° | 180.0° |
| C4 | C5 | C6 | H4 | 180.0° | 179.8° |
| C4 | C5 | C6 | C7 | 0.1° | 0.1° |
| C4 | C5 | C6 | H5 | 179.9° | 179.9° |
| C5 | C4 | C3 | H2 | 179.6° | 180.0° |
| C5 | C6 | C7 | H5 | 180.0° | 180.0° |
| C5 | C6 | C7 | C | 179.4° | 180.0° |
| C5 | C6 | C7 | C2 | 0.0° | 0.0° |
| C6 | C5 | C4 | H3 | 179.6° | 179.8° |
| C6 | C7 | C | C2 | 179.5° | 180.0° |
| C7 | C6 | C5 | H4 | 179.9° | 179.9° |
| C | C7 | C6 | H5 | 0.6° | 0.0° |
| C7 | C | N | H | 179.8° | 179.9° |
| C7 | C | N | H1 | 0.2° | 0.1° |
| C2 | C7 | C6 | H5 | 180.0° | 180.0° |
| C7 | C2 | C3 | H2 | 179.7° | 179.9° |
| H4 | C5 | C6 | H5 | 0.1° | 0.1° |
| H4 | C5 | C4 | H3 | 0.4° | 0.0° |
| H3 | C4 | C3 | H2 | 0.4° | 0.0° |
