Z5C
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | O1 | sing | 1.21Å | 1.42Å | Aromatic |
| N | C4 | doub | 1.31Å | 1.32Å | Aromatic |
| O2 | C5 | doub | 1.21Å | 1.24Å | |
| N1 | C5 | sing | 1.35Å | 1.33Å | |
| C5 | C4 | sing | 1.48Å | 1.49Å | |
| O1 | C2 | sing | 1.34Å | 1.35Å | Aromatic |
| C4 | C3 | sing | 1.42Å | 1.40Å | Aromatic |
| C2 | C3 | doub | 1.35Å | 1.34Å | Aromatic |
| C2 | C1 | sing | 1.51Å | 1.48Å | |
| C1 | O | sing | 1.43Å | 1.41Å | |
| C | O | sing | 1.43Å | 1.42Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| N1 | H2 | sing | 0.97Å | 1.00Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C1 | H4 | sing | 1.09Å | 1.10Å | |
| C1 | H5 | sing | 1.09Å | 1.10Å | |
| C | H6 | sing | 1.09Å | 1.10Å | |
| C | H7 | sing | 1.09Å | 1.10Å | |
| C | H8 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | N | C4 | 104.6° | 111.4° |
| N | O1 | C2 | 108.3° | 111.8° |
| N | C4 | C5 | 120.6° | 126.9° |
| N | C4 | C3 | 112.0° | 106.2° |
| O2 | C5 | N1 | 123.3° | 120.0° |
| O2 | C5 | C4 | 120.5° | 120.0° |
| N1 | C5 | C4 | 116.3° | 120.0° |
| C5 | N1 | H1 | 120.0° | 120.1° |
| C5 | N1 | H2 | 120.0° | 120.0° |
| C5 | C4 | C3 | 127.4° | 126.9° |
| O1 | C2 | C3 | 110.0° | 106.7° |
| O1 | C2 | C1 | 115.6° | 126.6° |
| C4 | C3 | C2 | 105.1° | 103.9° |
| C4 | C3 | H3 | 127.5° | 128.1° |
| C3 | C2 | C1 | 134.3° | 126.7° |
| C2 | C3 | H3 | 127.5° | 128.0° |
| C2 | C1 | O | 109.7° | 109.5° |
| C2 | C1 | H4 | 109.4° | 109.5° |
| C2 | C1 | H5 | 109.4° | 109.4° |
| C1 | O | C | 112.0° | 114.0° |
| O | C1 | H4 | 109.4° | 109.5° |
| O | C1 | H5 | 109.4° | 109.5° |
| O | C | H6 | 109.5° | 109.5° |
| O | C | H7 | 109.5° | 109.5° |
| O | C | H8 | 109.4° | 109.5° |
| H1 | N1 | H2 | 120.0° | 120.0° |
| H4 | C1 | H5 | 109.5° | 109.5° |
| H6 | C | H7 | 109.5° | 109.5° |
| H6 | C | H8 | 109.5° | 109.4° |
| H7 | C | H8 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | N | C4 | C5 | 179.6° | 179.8° |
| O1 | N | C4 | C3 | 0.3° | 0.0° |
| N | O1 | C2 | C3 | 0.4° | 0.4° |
| N | O1 | C2 | C1 | 178.3° | 180.0° |
| N | C4 | C5 | O2 | 56.4° | 179.7° |
| N | C4 | C5 | N1 | 122.8° | 0.3° |
| N | C4 | C5 | C3 | 179.9° | 179.7° |
| C4 | N | O1 | C2 | 0.0° | 0.3° |
| N | C4 | C3 | C2 | 0.6° | 0.3° |
| N | C4 | C3 | H3 | 179.4° | 179.8° |
| O2 | C5 | N1 | C4 | 179.1° | 180.0° |
| O2 | C5 | C4 | C3 | 123.6° | 0.1° |
| O2 | C5 | N1 | H1 | 0.0° | 180.0° |
| O2 | C5 | N1 | H2 | 180.0° | 0.3° |
| N1 | C5 | C4 | C3 | 57.3° | 180.0° |
| C5 | N1 | H1 | H2 | 180.0° | 179.7° |
| C5 | C4 | C3 | C2 | 179.4° | 180.0° |
| C4 | C5 | N1 | H1 | 179.1° | 0.0° |
| C4 | C5 | N1 | H2 | 0.9° | 179.7° |
| C5 | C4 | C3 | H3 | 0.6° | 0.0° |
| O1 | C2 | C3 | C4 | 0.5° | 0.4° |
| O1 | C2 | C3 | C1 | 178.3° | 179.6° |
| O1 | C2 | C1 | O | 114.6° | 90.0° |
| O1 | C2 | C3 | H3 | 179.5° | 179.6° |
| O1 | C2 | C1 | H4 | 5.4° | 30.0° |
| O1 | C2 | C1 | H5 | 125.4° | 150.0° |
| C4 | C3 | C2 | H3 | 180.0° | 179.9° |
| C4 | C3 | C2 | C1 | 177.7° | 180.0° |
| C3 | C2 | C1 | O | 63.6° | 89.4° |
| C3 | C2 | C1 | H4 | 176.3° | 150.6° |
| C3 | C2 | C1 | H5 | 56.4° | 30.6° |
| C2 | C1 | O | H4 | 120.0° | 120.0° |
| C2 | C1 | O | H5 | 120.0° | 120.0° |
| C2 | C1 | O | C | 84.6° | 180.0° |
| C1 | C2 | C3 | H3 | 2.3° | 0.1° |
| C2 | C1 | H4 | H5 | 119.9° | 120.0° |
| O | C1 | H4 | H5 | 119.9° | 120.1° |
| C1 | O | C | H6 | 180.0° | 180.0° |
| C1 | O | C | H7 | 60.0° | 60.0° |
| C1 | O | C | H8 | 60.0° | 60.0° |
| C | O | C1 | H4 | 35.4° | 60.0° |
| C | O | C1 | H5 | 155.3° | 60.0° |
| O | C | H6 | H7 | 120.0° | 120.0° |
| O | C | H6 | H8 | 120.0° | 120.0° |
| O | C | H7 | H8 | 120.0° | 120.0° |
| H6 | C | H7 | H8 | 120.0° | 120.0° |
