PK7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CL9 | C8 | sing | 1.74Å | 1.75Å | |
| N1 | C2 | sing | 1.47Å | 1.48Å | |
| C10 | C8 | doub | 1.38Å | 1.40Å | Aromatic |
| C10 | C3 | sing | 1.38Å | 1.40Å | Aromatic |
| C8 | C6 | sing | 1.39Å | 1.39Å | Aromatic |
| C2 | C3 | sing | 1.51Å | 1.54Å | |
| C3 | C4 | doub | 1.38Å | 1.40Å | Aromatic |
| C6 | F7 | sing | 1.35Å | 1.33Å | |
| C6 | C5 | doub | 1.38Å | 1.40Å | Aromatic |
| C4 | C5 | sing | 1.38Å | 1.40Å | Aromatic |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C10 | H3 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| N1 | H6 | sing | 1.01Å | 1.00Å | |
| N1 | H7 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CL9 | C8 | C10 | 120.2° | 120.1° |
| CL9 | C8 | C6 | 119.7° | 120.0° |
| N1 | C2 | C3 | 109.0° | 109.5° |
| N1 | C2 | H1 | 109.6° | 109.5° |
| N1 | C2 | H2 | 109.6° | 109.5° |
| C2 | N1 | H6 | 109.5° | 111.0° |
| C2 | N1 | H7 | 109.5° | 111.0° |
| C8 | C10 | C3 | 120.4° | 120.0° |
| C10 | C8 | C6 | 120.1° | 120.0° |
| C8 | C10 | H3 | 119.8° | 119.9° |
| C10 | C3 | C2 | 120.1° | 120.0° |
| C10 | C3 | C4 | 119.3° | 120.1° |
| C3 | C10 | H3 | 119.8° | 120.0° |
| C8 | C6 | F7 | 119.9° | 120.1° |
| C8 | C6 | C5 | 119.9° | 119.9° |
| C2 | C3 | C4 | 120.6° | 119.9° |
| C3 | C2 | H1 | 109.6° | 109.5° |
| C3 | C2 | H2 | 109.6° | 109.5° |
| C3 | C4 | C5 | 120.3° | 120.0° |
| C3 | C4 | H4 | 119.8° | 120.0° |
| F7 | C6 | C5 | 120.2° | 120.0° |
| C6 | C5 | C4 | 120.0° | 120.0° |
| C6 | C5 | H5 | 120.0° | 120.0° |
| C5 | C4 | H4 | 119.9° | 120.0° |
| C4 | C5 | H5 | 120.0° | 120.0° |
| H1 | C2 | H2 | 109.5° | 109.5° |
| H6 | N1 | H7 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CL9 | C8 | C10 | C6 | 180.0° | 180.0° |
| CL9 | C8 | C10 | C3 | 179.9° | 179.9° |
| CL9 | C8 | C6 | F7 | 0.1° | 0.0° |
| CL9 | C8 | C6 | C5 | 179.9° | 179.8° |
| CL9 | C8 | C10 | H3 | 0.1° | 0.0° |
| N1 | C2 | C3 | C10 | 5.3° | 89.7° |
| N1 | C2 | C3 | H1 | 119.9° | 120.0° |
| N1 | C2 | C3 | H2 | 119.9° | 120.0° |
| N1 | C2 | C3 | C4 | 174.7° | 90.0° |
| N1 | C2 | H1 | H2 | 120.2° | 120.0° |
| C2 | N1 | H6 | H7 | 120.0° | 124.0° |
| C8 | C10 | C3 | H3 | 180.0° | 179.9° |
| C8 | C10 | C3 | C2 | 179.9° | 180.0° |
| C8 | C10 | C3 | C4 | 0.1° | 0.3° |
| C10 | C8 | C6 | F7 | 179.9° | 179.9° |
| C10 | C8 | C6 | C5 | 0.1° | 0.2° |
| C3 | C10 | C8 | C6 | 0.1° | 0.1° |
| C10 | C3 | C2 | C4 | 180.0° | 179.7° |
| C10 | C3 | C4 | C5 | 0.1° | 0.3° |
| C10 | C3 | C2 | H1 | 114.6° | 30.3° |
| C10 | C3 | C2 | H2 | 125.2° | 150.3° |
| C10 | C3 | C4 | H4 | 179.9° | 179.7° |
| C8 | C6 | F7 | C5 | 180.0° | 179.8° |
| C8 | C6 | C5 | C4 | 0.0° | 0.2° |
| C6 | C8 | C10 | H3 | 179.9° | 180.0° |
| C8 | C6 | C5 | H5 | 180.0° | 179.7° |
| C2 | C3 | C4 | C5 | 180.0° | 180.0° |
| C3 | C2 | H1 | H2 | 120.2° | 120.0° |
| C2 | C3 | C10 | H3 | 0.0° | 0.0° |
| C2 | C3 | C4 | H4 | 0.0° | 0.0° |
| C3 | C2 | N1 | H6 | 180.0° | 180.0° |
| C3 | C2 | N1 | H7 | 60.0° | 56.1° |
| C3 | C4 | C5 | C6 | 0.0° | 0.0° |
| C3 | C4 | C5 | H4 | 180.0° | 180.0° |
| C4 | C3 | C2 | H1 | 65.4° | 150.0° |
| C4 | C3 | C2 | H2 | 54.8° | 30.0° |
| C4 | C3 | C10 | H3 | 179.9° | 179.8° |
| C3 | C4 | C5 | H5 | 180.0° | 179.9° |
| F7 | C6 | C5 | C4 | 180.0° | 180.0° |
| F7 | C6 | C5 | H5 | 0.0° | 0.1° |
| C6 | C5 | C4 | H5 | 180.0° | 179.9° |
| C6 | C5 | C4 | H4 | 180.0° | 180.0° |
| H1 | C2 | N1 | H6 | 60.1° | 60.0° |
| H1 | C2 | N1 | H7 | 59.9° | 176.0° |
| H2 | C2 | N1 | H6 | 60.0° | 60.0° |
| H2 | C2 | N1 | H7 | 180.0° | 64.0° |
| H4 | C4 | C5 | H5 | 0.0° | 0.0° |
