F4N
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C16 | N20 | sing | 1.33Å | 1.33Å | Aromatic |
| C16 | C17 | doub | 1.38Å | 1.33Å | Aromatic |
| N20 | C19 | doub | 1.33Å | 1.33Å | Aromatic |
| C17 | C15 | sing | 1.47Å | 1.35Å | |
| C17 | N18 | sing | 1.38Å | 1.35Å | Aromatic |
| C13 | N12 | sing | 1.46Å | 1.51Å | |
| C15 | N14 | doub | 1.30Å | 1.35Å | |
| C19 | C26 | sing | 1.41Å | 1.33Å | Aromatic |
| C19 | N18 | sing | 1.37Å | 1.34Å | Aromatic |
| C26 | C25 | doub | 1.36Å | 1.39Å | Aromatic |
| N18 | C23 | sing | 1.36Å | 1.40Å | Aromatic |
| N14 | N12 | sing | 1.40Å | 1.28Å | |
| N12 | S9 | sing | 1.66Å | 1.74Å | |
| C7 | C1 | sing | 1.51Å | 1.39Å | |
| C25 | C24 | sing | 1.40Å | 1.39Å | Aromatic |
| C23 | C24 | doub | 1.35Å | 1.39Å | Aromatic |
| S9 | O11 | doub | 1.42Å | 1.52Å | |
| S9 | C6 | sing | 1.76Å | 1.75Å | |
| S9 | O10 | doub | 1.42Å | 1.53Å | |
| C24 | BR2 | sing | 1.89Å | 1.90Å | |
| C1 | C6 | doub | 1.38Å | 1.39Å | Aromatic |
| C1 | C2 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | C5 | sing | 1.38Å | 1.40Å | Aromatic |
| C2 | C3 | doub | 1.38Å | 1.40Å | Aromatic |
| C5 | C4 | doub | 1.38Å | 1.39Å | Aromatic |
| C3 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
| C4 | N8 | sing | 1.48Å | 1.35Å | |
| N8 | O21 | doub | 1.22Å | 1.46Å | |
| N8 | O22 | sing | 1.22Å | 1.41Å | |
| C7 | H1 | sing | 1.09Å | 1.10Å | |
| C7 | H2 | sing | 1.09Å | 1.10Å | |
| C7 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.08Å | 1.08Å | |
| C3 | H5 | sing | 1.08Å | 1.08Å | |
| C5 | H6 | sing | 1.08Å | 1.08Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H8 | sing | 1.09Å | 1.10Å | |
| C13 | H9 | sing | 1.09Å | 1.10Å | |
| C15 | H10 | sing | 1.08Å | 1.08Å | |
| C16 | H11 | sing | 1.08Å | 1.08Å | |
| C23 | H12 | sing | 1.08Å | 1.08Å | |
| C25 | H13 | sing | 1.08Å | 1.08Å | |
| C26 | H14 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N20 | C16 | C17 | 108.3° | 108.2° |
| C16 | N20 | C19 | 107.7° | 109.7° |
| N20 | C16 | H11 | 125.8° | 125.9° |
| C16 | C17 | C15 | 118.3° | 126.7° |
| C16 | C17 | N18 | 108.1° | 106.6° |
| C17 | C16 | H11 | 125.8° | 125.9° |
| N20 | C19 | C26 | 131.5° | 131.9° |
| N20 | C19 | N18 | 108.8° | 108.5° |
| C15 | C17 | N18 | 132.3° | 126.7° |
| C17 | C15 | N14 | 119.5° | 120.0° |
| C17 | C15 | H10 | 120.3° | 120.0° |
| C17 | N18 | C19 | 106.6° | 107.0° |
| C17 | N18 | C23 | 130.1° | 132.5° |
| C13 | N12 | N14 | 121.8° | 120.0° |
| C13 | N12 | S9 | 119.2° | 120.0° |
| N12 | C13 | H7 | 109.5° | 109.5° |
| N12 | C13 | H8 | 109.5° | 109.4° |
| N12 | C13 | H9 | 109.4° | 109.5° |
| C15 | N14 | N12 | 118.3° | 120.0° |
| N14 | C15 | H10 | 120.3° | 120.0° |
| C26 | C19 | N18 | 119.6° | 119.5° |
| C19 | C26 | C25 | 121.0° | 119.4° |
| C19 | C26 | H14 | 119.6° | 120.3° |
| C19 | N18 | C23 | 122.8° | 120.6° |
| C26 | C25 | C24 | 120.1° | 119.7° |
| C26 | C25 | H13 | 119.9° | 120.1° |
| C25 | C26 | H14 | 119.5° | 120.3° |
| N18 | C23 | C24 | 117.7° | 120.6° |
| N18 | C23 | H12 | 121.1° | 119.7° |
| N14 | N12 | S9 | 108.9° | 120.0° |
| N12 | S9 | O11 | 112.7° | 106.4° |
| N12 | S9 | C6 | 110.3° | 107.2° |
| N12 | S9 | O10 | 107.7° | 106.4° |
| C7 | C1 | C6 | 122.3° | 120.0° |
| C7 | C1 | C2 | 119.3° | 120.0° |
| C1 | C7 | H1 | 109.5° | 109.5° |
| C1 | C7 | H2 | 109.5° | 109.5° |
| C1 | C7 | H3 | 109.5° | 109.5° |
| C25 | C24 | C23 | 118.6° | 120.2° |
| C25 | C24 | BR2 | 120.2° | 119.9° |
| C24 | C25 | H13 | 119.9° | 120.2° |
| C23 | C24 | BR2 | 121.1° | 119.9° |
| C24 | C23 | H12 | 121.1° | 119.7° |
| O11 | S9 | C6 | 109.0° | 106.5° |
| O11 | S9 | O10 | 107.8° | 123.2° |
| C6 | S9 | O10 | 109.2° | 106.4° |
| S9 | C6 | C1 | 123.8° | 120.0° |
| S9 | C6 | C5 | 116.4° | 120.0° |
| C6 | C1 | C2 | 118.4° | 120.0° |
| C1 | C6 | C5 | 119.8° | 120.0° |
| C1 | C2 | C3 | 121.5° | 120.0° |
| C1 | C2 | H4 | 119.2° | 119.9° |
| C6 | C5 | C4 | 122.2° | 120.0° |
| C6 | C5 | H6 | 118.9° | 120.0° |
| C2 | C3 | C4 | 120.4° | 120.0° |
| C3 | C2 | H4 | 119.3° | 120.1° |
| C2 | C3 | H5 | 119.8° | 120.0° |
| C5 | C4 | C3 | 117.7° | 120.0° |
| C5 | C4 | N8 | 120.2° | 120.0° |
| C4 | C5 | H6 | 118.9° | 120.0° |
| C3 | C4 | N8 | 122.1° | 120.0° |
| C4 | C3 | H5 | 119.8° | 120.0° |
| C4 | N8 | O21 | 119.5° | 120.0° |
| C4 | N8 | O22 | 120.6° | 120.0° |
| O21 | N8 | O22 | 119.9° | 119.9° |
| H1 | C7 | H2 | 109.4° | 109.4° |
| H1 | C7 | H3 | 109.5° | 109.5° |
| H2 | C7 | H3 | 109.5° | 109.5° |
| H7 | C13 | H8 | 109.5° | 109.5° |
| H7 | C13 | H9 | 109.5° | 109.5° |
| H8 | C13 | H9 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N20 | C16 | C17 | H11 | 180.0° | 179.9° |
| N20 | C16 | C17 | C15 | 174.3° | 180.0° |
| N20 | C16 | C17 | N18 | 5.7° | 0.3° |
| C16 | N20 | C19 | C26 | 179.7° | 180.0° |
| C16 | N20 | C19 | N18 | 1.7° | 0.2° |
| C17 | C16 | N20 | C19 | 2.5° | 0.1° |
| C16 | C17 | C15 | N18 | 165.2° | 179.6° |
| C16 | C17 | C15 | N14 | 163.8° | 0.4° |
| C16 | C17 | N18 | C19 | 6.6° | 0.5° |
| C16 | C17 | N18 | C23 | 178.6° | 179.7° |
| C16 | C17 | C15 | H10 | 16.2° | 179.6° |
| N20 | C19 | N18 | C17 | 5.1° | 0.4° |
| N20 | C19 | C26 | N18 | 178.6° | 179.8° |
| N20 | C19 | C26 | C25 | 179.9° | 179.2° |
| N20 | C19 | N18 | C23 | 177.7° | 179.7° |
| C19 | N20 | C16 | H11 | 177.4° | 179.9° |
| N20 | C19 | C26 | H14 | 0.1° | 0.1° |
| C17 | C15 | N14 | H10 | 180.0° | 180.0° |
| C15 | C17 | N18 | C19 | 173.0° | 179.9° |
| C15 | C17 | N18 | C23 | 15.1° | 0.1° |
| C17 | C15 | N14 | N12 | 179.7° | 180.0° |
| C15 | C17 | C16 | H11 | 5.7° | 0.1° |
| N18 | C17 | C15 | N14 | 1.5° | 180.0° |
| C17 | N18 | C19 | C26 | 176.0° | 179.7° |
| C17 | N18 | C19 | C23 | 172.6° | 179.8° |
| C17 | N18 | C23 | C24 | 174.3° | 179.9° |
| N18 | C17 | C15 | H10 | 178.5° | 0.0° |
| N18 | C17 | C16 | H11 | 174.2° | 179.8° |
| C17 | N18 | C23 | H12 | 5.7° | 0.1° |
| C13 | N12 | N14 | C15 | 50.4° | 0.1° |
| C13 | N12 | N14 | S9 | 145.1° | 179.9° |
| C13 | N12 | S9 | O11 | 16.8° | 143.1° |
| C13 | N12 | S9 | C6 | 105.3° | 103.3° |
| C13 | N12 | S9 | O10 | 135.6° | 10.2° |
| N12 | C13 | H7 | H8 | 120.0° | 120.0° |
| N12 | C13 | H7 | H9 | 120.0° | 120.0° |
| N12 | C13 | H8 | H9 | 120.0° | 119.9° |
| C15 | N14 | N12 | S9 | 164.4° | 180.0° |
| C19 | C26 | C25 | H14 | 180.0° | 179.2° |
| C26 | C19 | N18 | C23 | 3.4° | 0.1° |
| C19 | C26 | C25 | C24 | 0.5° | 0.8° |
| C19 | C26 | C25 | H13 | 179.5° | 179.7° |
| N18 | C19 | C26 | C25 | 1.3° | 0.6° |
| C19 | N18 | C23 | C24 | 3.6° | 0.2° |
| C19 | N18 | C23 | H12 | 176.4° | 179.8° |
| N18 | C19 | C26 | H14 | 178.7° | 179.7° |
| C26 | C25 | C24 | H13 | 180.0° | 179.5° |
| C26 | C25 | C24 | C23 | 0.2° | 0.5° |
| C26 | C25 | C24 | BR2 | 179.9° | 179.5° |
| N18 | C23 | C24 | C25 | 1.7° | 0.0° |
| N18 | C23 | C24 | H12 | 180.0° | 180.0° |
| N18 | C23 | C24 | BR2 | 178.2° | 180.0° |
| N14 | N12 | S9 | O11 | 163.0° | 36.9° |
| N14 | N12 | S9 | C6 | 40.9° | 76.7° |
| N14 | N12 | S9 | O10 | 78.2° | 169.8° |
| N14 | N12 | C13 | H7 | 180.0° | 84.4° |
| N14 | N12 | C13 | H8 | 60.0° | 35.7° |
| N14 | N12 | C13 | H9 | 60.0° | 155.6° |
| N12 | N14 | C15 | H10 | 0.3° | 0.0° |
| N12 | S9 | O11 | C6 | 122.8° | 114.1° |
| N12 | S9 | O11 | O10 | 118.7° | 122.9° |
| N12 | S9 | C6 | O10 | 118.2° | 113.5° |
| N12 | S9 | C6 | C1 | 57.7° | 64.1° |
| N12 | S9 | C6 | C5 | 123.3° | 116.1° |
| S9 | N12 | C13 | H7 | 38.3° | 95.6° |
| S9 | N12 | C13 | H8 | 158.3° | 144.4° |
| S9 | N12 | C13 | H9 | 81.7° | 24.5° |
| C7 | C1 | C6 | S9 | 0.9° | 0.0° |
| C7 | C1 | C6 | C2 | 179.2° | 179.8° |
| C7 | C1 | C6 | C5 | 179.9° | 179.7° |
| C7 | C1 | C2 | C3 | 179.8° | 180.0° |
| C1 | C7 | H1 | H2 | 120.0° | 120.0° |
| C1 | C7 | H1 | H3 | 120.0° | 120.0° |
| C1 | C7 | H2 | H3 | 120.0° | 120.0° |
| C7 | C1 | C2 | H4 | 0.2° | 0.0° |
| C25 | C24 | C23 | BR2 | 179.9° | 180.0° |
| C25 | C24 | C23 | H12 | 178.3° | 180.0° |
| C24 | C25 | C26 | H14 | 179.5° | 179.9° |
| C23 | C24 | C25 | H13 | 179.8° | 180.0° |
| O11 | S9 | C6 | O10 | 117.6° | 132.9° |
| O11 | S9 | C6 | C1 | 66.5° | 177.6° |
| O11 | S9 | C6 | C5 | 112.5° | 2.6° |
| S9 | C6 | C1 | C5 | 179.0° | 179.8° |
| S9 | C6 | C1 | C2 | 179.9° | 179.7° |
| S9 | C6 | C5 | C4 | 180.0° | 179.7° |
| S9 | C6 | C5 | H6 | 0.1° | 0.0° |
| O10 | S9 | C6 | C1 | 175.9° | 49.4° |
| O10 | S9 | C6 | C5 | 5.1° | 130.4° |
| BR2 | C24 | C23 | H12 | 1.7° | 0.0° |
| BR2 | C24 | C25 | H13 | 0.1° | 0.0° |
| C6 | C1 | C2 | C3 | 0.9° | 0.2° |
| C1 | C6 | C5 | C4 | 1.0° | 0.5° |
| C6 | C1 | C7 | H1 | 89.6° | 83.1° |
| C6 | C1 | C7 | H2 | 150.4° | 156.9° |
| C6 | C1 | C7 | H3 | 30.4° | 36.9° |
| C6 | C1 | C2 | H4 | 179.1° | 179.8° |
| C1 | C6 | C5 | H6 | 179.0° | 179.8° |
| C2 | C1 | C6 | C5 | 0.9° | 0.5° |
| C1 | C2 | C3 | H4 | 180.0° | 180.0° |
| C1 | C2 | C3 | C4 | 1.1° | 0.0° |
| C2 | C1 | C7 | H1 | 89.6° | 96.7° |
| C2 | C1 | C7 | H2 | 30.4° | 23.3° |
| C2 | C1 | C7 | H3 | 150.4° | 143.3° |
| C1 | C2 | C3 | H5 | 178.9° | 180.0° |
| C6 | C5 | C4 | H6 | 180.0° | 179.7° |
| C6 | C5 | C4 | C3 | 1.1° | 0.3° |
| C6 | C5 | C4 | N8 | 179.8° | 179.8° |
| C2 | C3 | C4 | C5 | 1.1° | 0.0° |
| C2 | C3 | C4 | H5 | 180.0° | 180.0° |
| C2 | C3 | C4 | N8 | 179.8° | 179.9° |
| C5 | C4 | C3 | N8 | 179.1° | 179.9° |
| C5 | C4 | N8 | O21 | 0.0° | 179.9° |
| C5 | C4 | N8 | O22 | 179.3° | 0.1° |
| C5 | C4 | C3 | H5 | 178.9° | 179.9° |
| C3 | C4 | N8 | O21 | 179.0° | 0.0° |
| C3 | C4 | N8 | O22 | 0.3° | 180.0° |
| C4 | C3 | C2 | H4 | 178.9° | 180.0° |
| C3 | C4 | C5 | H6 | 178.9° | 180.0° |
| C4 | N8 | O21 | O22 | 179.3° | 180.0° |
| N8 | C4 | C3 | H5 | 0.2° | 0.0° |
| N8 | C4 | C5 | H6 | 0.2° | 0.1° |
| H1 | C7 | H2 | H3 | 120.0° | 120.0° |
| H4 | C2 | C3 | H5 | 1.1° | 0.0° |
| H7 | C13 | H8 | H9 | 120.0° | 120.0° |
| H13 | C25 | C26 | H14 | 0.5° | 0.6° |
