QI8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F14 | C13 | sing | 1.35Å | 1.37Å | |
| C12 | C13 | doub | 1.38Å | 1.38Å | Aromatic |
| C12 | C10 | sing | 1.38Å | 1.38Å | Aromatic |
| C13 | C02 | sing | 1.38Å | 1.39Å | Aromatic |
| F11 | C10 | sing | 1.35Å | 1.36Å | |
| C10 | C08 | doub | 1.38Å | 1.38Å | Aromatic |
| C02 | F01 | sing | 1.35Å | 1.36Å | |
| C02 | C03 | doub | 1.40Å | 1.39Å | Aromatic |
| C08 | C03 | sing | 1.40Å | 1.38Å | Aromatic |
| C08 | F09 | sing | 1.35Å | 1.36Å | |
| C03 | C04 | sing | 1.48Å | 1.53Å | |
| N05 | C04 | sing | 1.35Å | 1.45Å | |
| N05 | O06 | sing | 1.42Å | 1.41Å | |
| C04 | O07 | doub | 1.21Å | 1.18Å | |
| C12 | H1 | sing | 1.08Å | 1.08Å | |
| N05 | H2 | sing | 0.97Å | 1.00Å | |
| O06 | H3 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F14 | C13 | C12 | 118.5° | 119.9° |
| F14 | C13 | C02 | 120.7° | 120.0° |
| C13 | C12 | C10 | 118.9° | 120.3° |
| C12 | C13 | C02 | 120.8° | 120.2° |
| C13 | C12 | H1 | 120.6° | 119.9° |
| C12 | C10 | F11 | 120.2° | 120.0° |
| C12 | C10 | C08 | 120.5° | 120.2° |
| C10 | C12 | H1 | 120.6° | 119.8° |
| C13 | C02 | F01 | 119.6° | 120.1° |
| C13 | C02 | C03 | 120.2° | 119.8° |
| F11 | C10 | C08 | 119.3° | 119.9° |
| C10 | C08 | C03 | 121.0° | 119.8° |
| C10 | C08 | F09 | 119.2° | 120.1° |
| F01 | C02 | C03 | 120.2° | 120.1° |
| C02 | C03 | C08 | 118.7° | 119.7° |
| C02 | C03 | C04 | 122.3° | 120.2° |
| C03 | C08 | F09 | 119.8° | 120.1° |
| C08 | C03 | C04 | 119.0° | 120.2° |
| C03 | C04 | N05 | 120.5° | 120.0° |
| C03 | C04 | O07 | 122.3° | 120.0° |
| C04 | N05 | O06 | 121.3° | 120.0° |
| N05 | C04 | O07 | 117.1° | 120.0° |
| C04 | N05 | H2 | 119.4° | 120.0° |
| O06 | N05 | H2 | 119.4° | 120.0° |
| N05 | O06 | H3 | 109.5° | 114.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F14 | C13 | C12 | C02 | 179.9° | 179.9° |
| F14 | C13 | C12 | C10 | 180.0° | 179.9° |
| F14 | C13 | C02 | F01 | 0.3° | 0.1° |
| F14 | C13 | C02 | C03 | 180.0° | 179.9° |
| F14 | C13 | C12 | H1 | 0.1° | 0.1° |
| C13 | C12 | C10 | H1 | 180.0° | 180.0° |
| C13 | C12 | C10 | F11 | 180.0° | 179.7° |
| C13 | C12 | C10 | C08 | 0.0° | 0.0° |
| C12 | C13 | C02 | F01 | 179.8° | 180.0° |
| C12 | C13 | C02 | C03 | 0.1° | 0.0° |
| C10 | C12 | C13 | C02 | 0.2° | 0.0° |
| C12 | C10 | F11 | C08 | 180.0° | 179.7° |
| C12 | C10 | C08 | C03 | 0.2° | 0.0° |
| C12 | C10 | C08 | F09 | 179.9° | 180.0° |
| C13 | C02 | F01 | C03 | 179.7° | 180.0° |
| C13 | C02 | C03 | C08 | 0.1° | 0.0° |
| C13 | C02 | C03 | C04 | 178.4° | 180.0° |
| C02 | C13 | C12 | H1 | 179.8° | 180.0° |
| F11 | C10 | C08 | C03 | 179.8° | 179.7° |
| F11 | C10 | C08 | F09 | 0.1° | 0.3° |
| F11 | C10 | C12 | H1 | 0.0° | 0.3° |
| C10 | C08 | C03 | C02 | 0.3° | 0.0° |
| C10 | C08 | C03 | F09 | 179.7° | 180.0° |
| C10 | C08 | C03 | C04 | 178.6° | 180.0° |
| C08 | C10 | C12 | H1 | 180.0° | 180.0° |
| F01 | C02 | C03 | C08 | 179.6° | 180.0° |
| F01 | C02 | C03 | C04 | 1.3° | 0.0° |
| C02 | C03 | C08 | C04 | 178.3° | 179.9° |
| C02 | C03 | C08 | F09 | 179.9° | 180.0° |
| C02 | C03 | C04 | N05 | 28.0° | 89.9° |
| C02 | C03 | C04 | O07 | 155.6° | 90.0° |
| C08 | C03 | C04 | N05 | 150.3° | 90.0° |
| C08 | C03 | C04 | O07 | 26.2° | 90.0° |
| F09 | C08 | C03 | C04 | 1.7° | 0.0° |
| C03 | C04 | N05 | O07 | 176.7° | 179.9° |
| C03 | C04 | N05 | O06 | 178.4° | 180.0° |
| C03 | C04 | N05 | H2 | 1.6° | 0.1° |
| C04 | N05 | O06 | H2 | 180.0° | 179.9° |
| C04 | N05 | O06 | H3 | 0.8° | 179.9° |
| O06 | N05 | C04 | O07 | 1.7° | 0.1° |
| O07 | C04 | N05 | H2 | 178.3° | 180.0° |
| H2 | N05 | O06 | H3 | 179.2° | 0.0° |
