CP7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C2 | doub | 1.32Å | 1.36Å | Aromatic |
| N1 | C3 | sing | 1.33Å | 1.42Å | Aromatic |
| C2 | N6 | sing | 1.32Å | 1.33Å | Aromatic |
| C2 | N14 | sing | 1.38Å | 1.41Å | |
| C3 | C4 | doub | 1.41Å | 1.47Å | Aromatic |
| C3 | N13 | sing | 1.38Å | 1.34Å | |
| C4 | C5 | sing | 1.39Å | 1.43Å | Aromatic |
| C4 | C7 | sing | 1.48Å | 1.52Å | Aromatic |
| C5 | N6 | doub | 1.32Å | 1.41Å | Aromatic |
| C5 | C15 | sing | 1.51Å | 1.52Å | |
| C7 | C8 | doub | 1.39Å | 1.45Å | Aromatic |
| C7 | C12 | sing | 1.39Å | 1.43Å | Aromatic |
| C8 | C9 | sing | 1.38Å | 1.44Å | Aromatic |
| C8 | H8 | sing | 1.08Å | 1.10Å | |
| C9 | C10 | doub | 1.38Å | 1.42Å | Aromatic |
| C9 | H9 | sing | 1.08Å | 1.10Å | |
| C10 | C11 | sing | 1.38Å | 1.43Å | Aromatic |
| C10 | H10 | sing | 1.08Å | 1.10Å | |
| C11 | C12 | doub | 1.38Å | 1.44Å | Aromatic |
| C11 | H11 | sing | 1.08Å | 1.10Å | |
| C12 | H12 | sing | 1.08Å | 1.10Å | |
| N13 | H131 | sing | 0.97Å | 1.02Å | |
| N13 | H132 | sing | 0.97Å | 1.02Å | |
| N14 | H141 | sing | 0.97Å | 1.02Å | |
| N14 | H142 | sing | 0.97Å | 1.02Å | |
| C15 | C16 | sing | 1.53Å | 1.49Å | |
| C15 | H151 | sing | 1.09Å | 1.11Å | |
| C15 | H152 | sing | 1.09Å | 1.12Å | |
| C16 | H161 | sing | 1.09Å | 1.11Å | |
| C16 | H162 | sing | 1.09Å | 1.12Å | |
| C16 | H163 | sing | 1.09Å | 1.12Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | N1 | C3 | 115.5° | 120.7° |
| N1 | C2 | N6 | 127.3° | 121.9° |
| N1 | C2 | N14 | 115.5° | 119.1° |
| N1 | C3 | C4 | 123.2° | 118.9° |
| N1 | C3 | N13 | 116.0° | 120.5° |
| N6 | C2 | N14 | 117.2° | 119.0° |
| C2 | N6 | C5 | 117.9° | 121.1° |
| C2 | N14 | H141 | 115.5° | 120.0° |
| C2 | N14 | H142 | 117.2° | 120.1° |
| C4 | C3 | N13 | 120.9° | 120.5° |
| C3 | C4 | C5 | 113.4° | 118.2° |
| C3 | C4 | C7 | 119.5° | 120.9° |
| C3 | N13 | H131 | 116.0° | 120.0° |
| C3 | N13 | H132 | 120.9° | 120.0° |
| C5 | C4 | C7 | 127.0° | 120.9° |
| C4 | C5 | N6 | 122.7° | 119.1° |
| C4 | C5 | C15 | 125.8° | 120.4° |
| C4 | C7 | C8 | 121.5° | 120.1° |
| C4 | C7 | C12 | 120.3° | 120.1° |
| N6 | C5 | C15 | 111.5° | 120.5° |
| C5 | C15 | C16 | 111.9° | 109.5° |
| C5 | C15 | H151 | 111.3° | 109.5° |
| C5 | C15 | H152 | 111.3° | 109.5° |
| C8 | C7 | C12 | 118.2° | 119.7° |
| C7 | C8 | C9 | 119.8° | 119.9° |
| C7 | C8 | H8 | 120.1° | 120.1° |
| C7 | C12 | C11 | 122.7° | 119.9° |
| C7 | C12 | H12 | 118.7° | 120.0° |
| C9 | C8 | H8 | 120.1° | 120.1° |
| C8 | C9 | C10 | 119.9° | 120.2° |
| C8 | C9 | H9 | 120.0° | 119.9° |
| C10 | C9 | H9 | 120.1° | 119.9° |
| C9 | C10 | C11 | 121.8° | 120.2° |
| C9 | C10 | H10 | 119.1° | 119.9° |
| C11 | C10 | H10 | 119.1° | 119.9° |
| C10 | C11 | C12 | 117.6° | 120.1° |
| C10 | C11 | H11 | 121.2° | 119.9° |
| C12 | C11 | H11 | 121.2° | 119.9° |
| C11 | C12 | H12 | 118.6° | 120.1° |
| H131 | N13 | H132 | 123.1° | 120.0° |
| H141 | N14 | H142 | 127.2° | 120.0° |
| C16 | C15 | H151 | 111.3° | 109.5° |
| C16 | C15 | H152 | 111.3° | 109.5° |
| C15 | C16 | H161 | 111.9° | 109.5° |
| C15 | C16 | H162 | 111.4° | 109.5° |
| C15 | C16 | H163 | 111.3° | 109.5° |
| H151 | C15 | H152 | 99.0° | 109.4° |
| H161 | C16 | H162 | 111.3° | 109.6° |
| H161 | C16 | H163 | 111.3° | 109.4° |
| H162 | C16 | H163 | 99.0° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1 | C2 | N6 | N14 | 179.9° | 179.9° |
| C2 | N1 | C3 | C4 | 0.0° | 0.2° |
| C2 | N1 | C3 | N13 | 179.8° | 179.9° |
| N1 | C2 | N6 | C5 | 0.3° | 0.1° |
| N1 | C2 | N14 | H141 | 180.0° | 0.0° |
| N1 | C2 | N14 | H142 | 0.0° | 179.9° |
| C3 | N1 | C2 | N6 | 0.2° | 0.1° |
| C3 | N1 | C2 | N14 | 179.7° | 180.0° |
| N1 | C3 | C4 | N13 | 179.8° | 179.7° |
| N1 | C3 | C4 | C5 | 0.1° | 0.5° |
| N1 | C3 | C4 | C7 | 179.6° | 180.0° |
| N1 | C3 | N13 | H131 | 180.0° | 0.0° |
| N1 | C3 | N13 | H132 | 0.2° | 180.0° |
| C2 | N6 | C5 | C4 | 0.2° | 0.2° |
| C2 | N6 | C5 | C15 | 179.9° | 180.0° |
| N6 | C2 | N14 | H141 | 0.0° | 179.9° |
| N6 | C2 | N14 | H142 | 180.0° | 0.0° |
| N14 | C2 | N6 | C5 | 179.6° | 180.0° |
| C2 | N14 | H141 | H142 | 180.0° | 180.0° |
| C3 | C4 | C5 | C7 | 179.7° | 179.5° |
| C3 | C4 | C5 | N6 | 0.0° | 0.5° |
| C3 | C4 | C5 | C15 | 179.9° | 179.7° |
| C3 | C4 | C7 | C8 | 69.2° | 68.6° |
| C3 | C4 | C7 | C12 | 110.3° | 111.6° |
| C4 | C3 | N13 | H131 | 0.1° | 179.7° |
| C4 | C3 | N13 | H132 | 180.0° | 0.3° |
| N13 | C3 | C4 | C5 | 179.7° | 179.8° |
| N13 | C3 | C4 | C7 | 0.5° | 0.3° |
| C3 | N13 | H131 | H132 | 179.8° | 180.0° |
| C4 | C5 | N6 | C15 | 179.9° | 179.8° |
| C5 | C4 | C7 | C8 | 111.1° | 111.9° |
| C5 | C4 | C7 | C12 | 69.4° | 68.0° |
| C4 | C5 | C15 | C16 | 122.0° | 93.1° |
| C4 | C5 | C15 | H151 | 112.8° | 26.9° |
| C4 | C5 | C15 | H152 | 3.3° | 146.9° |
| C7 | C4 | C5 | N6 | 179.7° | 180.0° |
| C7 | C4 | C5 | C15 | 0.5° | 0.2° |
| C4 | C7 | C8 | C12 | 179.5° | 179.9° |
| C4 | C7 | C8 | C9 | 179.5° | 180.0° |
| C4 | C7 | C8 | H8 | 0.5° | 0.0° |
| C4 | C7 | C12 | C11 | 179.5° | 179.7° |
| C4 | C7 | C12 | H12 | 0.5° | 0.2° |
| N6 | C5 | C15 | C16 | 57.9° | 86.7° |
| N6 | C5 | C15 | H151 | 67.4° | 153.3° |
| N6 | C5 | C15 | H152 | 176.9° | 33.3° |
| C5 | C15 | C16 | H151 | 125.3° | 120.0° |
| C5 | C15 | C16 | H152 | 125.2° | 120.0° |
| C5 | C15 | H151 | H152 | 117.2° | 120.0° |
| C5 | C15 | C16 | H161 | 180.0° | 175.2° |
| C5 | C15 | C16 | H162 | 54.7° | 64.7° |
| C5 | C15 | C16 | H163 | 54.8° | 55.2° |
| C7 | C8 | C9 | H8 | 180.0° | 180.0° |
| C7 | C8 | C9 | C10 | 0.1° | 0.0° |
| C7 | C8 | C9 | H9 | 179.9° | 180.0° |
| C8 | C7 | C12 | C11 | 0.0° | 0.5° |
| C8 | C7 | C12 | H12 | 180.0° | 180.0° |
| C12 | C7 | C8 | C9 | 0.0° | 0.2° |
| C12 | C7 | C8 | H8 | 180.0° | 179.8° |
| C7 | C12 | C11 | C10 | 0.1° | 0.6° |
| C7 | C12 | C11 | H12 | 180.0° | 179.5° |
| C7 | C12 | C11 | H11 | 180.0° | 179.8° |
| C8 | C9 | C10 | H9 | 180.0° | 179.9° |
| C8 | C9 | C10 | C11 | 0.2° | 0.1° |
| C8 | C9 | C10 | H10 | 179.8° | 180.0° |
| H8 | C8 | C9 | C10 | 179.9° | 180.0° |
| H8 | C8 | C9 | H9 | 0.1° | 0.0° |
| C9 | C10 | C11 | H10 | 180.0° | 179.8° |
| C9 | C10 | C11 | C12 | 0.2° | 0.4° |
| C9 | C10 | C11 | H11 | 179.9° | 180.0° |
| H9 | C9 | C10 | C11 | 179.8° | 179.9° |
| H9 | C9 | C10 | H10 | 0.2° | 0.1° |
| C10 | C11 | C12 | H11 | 180.0° | 179.6° |
| C10 | C11 | C12 | H12 | 179.9° | 179.9° |
| H10 | C10 | C11 | C12 | 179.8° | 179.8° |
| H10 | C10 | C11 | H11 | 0.1° | 0.1° |
| H11 | C11 | C12 | H12 | 0.0° | 0.3° |
| C16 | C15 | H151 | H152 | 117.2° | 120.0° |
| C15 | C16 | H161 | H162 | 125.3° | 120.1° |
| C15 | C16 | H161 | H163 | 125.2° | 120.0° |
| C15 | C16 | H162 | H163 | 117.2° | 119.9° |
| H151 | C15 | C16 | H161 | 54.7° | 64.8° |
| H151 | C15 | C16 | H162 | 180.0° | 55.4° |
| H151 | C15 | C16 | H163 | 70.5° | 175.3° |
| H152 | C15 | C16 | H161 | 54.8° | 55.2° |
| H152 | C15 | C16 | H162 | 70.5° | 175.3° |
| H152 | C15 | C16 | H163 | NaN° | 64.8° |
| H161 | C16 | H162 | H163 | 117.2° | 119.9° |
