2F4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C11 | C10 | sing | 1.39Å | 1.38Å | Aromatic |
| C11 | C12 | doub | 1.38Å | 1.38Å | Aromatic |
| C10 | C09 | doub | 1.40Å | 1.37Å | Aromatic |
| C06 | C07 | doub | 1.38Å | 1.38Å | Aromatic |
| C06 | C05 | sing | 1.40Å | 1.37Å | Aromatic |
| C07 | N08 | sing | 1.32Å | 1.33Å | Aromatic |
| C12 | N13 | sing | 1.32Å | 1.33Å | Aromatic |
| C09 | C05 | sing | 1.48Å | 1.38Å | |
| C09 | C14 | sing | 1.40Å | 1.38Å | Aromatic |
| C05 | C04 | doub | 1.39Å | 1.37Å | Aromatic |
| N08 | C03 | doub | 1.33Å | 1.34Å | Aromatic |
| N13 | C14 | doub | 1.32Å | 1.32Å | Aromatic |
| C14 | O15 | sing | 1.36Å | 1.38Å | |
| C04 | C03 | sing | 1.39Å | 1.38Å | Aromatic |
| O15 | C16 | sing | 1.36Å | 1.39Å | |
| C03 | N02 | sing | 1.39Å | 1.42Å | |
| C16 | C17 | doub | 1.39Å | 1.39Å | Aromatic |
| C16 | C33 | sing | 1.39Å | 1.37Å | Aromatic |
| N02 | C01 | sing | 1.46Å | 1.43Å | |
| C17 | C18 | sing | 1.38Å | 1.40Å | Aromatic |
| C33 | C32 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | C19 | doub | 1.39Å | 1.38Å | Aromatic |
| C32 | C19 | sing | 1.39Å | 1.38Å | Aromatic |
| C19 | N20 | sing | 1.40Å | 1.45Å | |
| N22 | C21 | doub | 1.31Å | 1.33Å | Aromatic |
| N22 | C23 | sing | 1.36Å | 1.38Å | Aromatic |
| N20 | C21 | sing | 1.38Å | 1.43Å | |
| C24 | C23 | doub | 1.40Å | 1.41Å | Aromatic |
| C24 | C25 | sing | 1.38Å | 1.38Å | Aromatic |
| C21 | N31 | sing | 1.37Å | 1.34Å | Aromatic |
| C23 | C30 | sing | 1.40Å | 1.35Å | Aromatic |
| C25 | C26 | doub | 1.39Å | 1.38Å | Aromatic |
| N31 | C30 | sing | 1.39Å | 1.37Å | Aromatic |
| C30 | C28 | doub | 1.39Å | 1.41Å | Aromatic |
| C26 | C28 | sing | 1.38Å | 1.37Å | Aromatic |
| C26 | F27 | sing | 1.35Å | 1.31Å | |
| C28 | F29 | sing | 1.35Å | 1.31Å | |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H2 | sing | 1.09Å | 1.10Å | |
| C01 | H3 | sing | 1.09Å | 1.10Å | |
| N02 | H4 | sing | 0.97Å | 1.00Å | |
| C04 | H5 | sing | 1.08Å | 1.08Å | |
| C06 | H6 | sing | 1.08Å | 1.08Å | |
| C07 | H7 | sing | 1.08Å | 1.08Å | |
| C10 | H8 | sing | 1.08Å | 1.08Å | |
| C11 | H9 | sing | 1.08Å | 1.08Å | |
| C12 | H10 | sing | 1.08Å | 1.08Å | |
| C17 | H11 | sing | 1.08Å | 1.08Å | |
| C18 | H12 | sing | 1.08Å | 1.08Å | |
| N20 | H13 | sing | 0.97Å | 1.00Å | |
| C24 | H15 | sing | 1.08Å | 1.08Å | |
| C25 | H16 | sing | 1.08Å | 1.08Å | |
| N31 | H17 | sing | 0.97Å | 1.00Å | |
| C32 | H18 | sing | 1.08Å | 1.08Å | |
| C33 | H19 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C10 | C11 | C12 | 120.2° | 119.4° |
| C11 | C10 | C09 | 117.8° | 118.4° |
| C11 | C10 | H8 | 121.1° | 120.8° |
| C10 | C11 | H9 | 119.9° | 120.3° |
| C11 | C12 | N13 | 120.6° | 121.1° |
| C12 | C11 | H9 | 119.9° | 120.3° |
| C11 | C12 | H10 | 119.7° | 119.5° |
| C10 | C09 | C05 | 120.4° | 120.6° |
| C10 | C09 | C14 | 120.0° | 118.9° |
| C09 | C10 | H8 | 121.1° | 120.8° |
| C07 | C06 | C05 | 120.1° | 119.2° |
| C06 | C07 | N08 | 121.0° | 121.0° |
| C07 | C06 | H6 | 120.0° | 120.4° |
| C06 | C07 | H7 | 119.5° | 119.6° |
| C06 | C05 | C09 | 122.2° | 120.9° |
| C06 | C05 | C04 | 117.8° | 118.3° |
| C05 | C06 | H6 | 119.9° | 120.4° |
| C07 | N08 | C03 | 120.3° | 121.9° |
| N08 | C07 | H7 | 119.5° | 119.5° |
| C12 | N13 | C14 | 120.5° | 121.8° |
| N13 | C12 | H10 | 119.7° | 119.5° |
| C05 | C09 | C14 | 119.5° | 120.6° |
| C09 | C05 | C04 | 120.0° | 120.9° |
| C09 | C14 | N13 | 121.0° | 120.5° |
| C09 | C14 | O15 | 118.2° | 119.8° |
| C05 | C04 | C03 | 120.6° | 119.0° |
| C05 | C04 | H5 | 119.7° | 120.5° |
| N08 | C03 | C04 | 120.2° | 120.7° |
| N08 | C03 | N02 | 120.5° | 119.7° |
| N13 | C14 | O15 | 120.8° | 119.7° |
| C14 | O15 | C16 | 114.1° | 118.0° |
| C04 | C03 | N02 | 119.2° | 119.6° |
| C03 | C04 | H5 | 119.7° | 120.5° |
| O15 | C16 | C17 | 121.8° | 120.0° |
| O15 | C16 | C33 | 118.2° | 120.0° |
| C03 | N02 | C01 | 119.9° | 120.0° |
| C03 | N02 | H4 | 106.8° | 119.9° |
| C17 | C16 | C33 | 119.9° | 120.0° |
| C16 | C17 | C18 | 120.2° | 120.0° |
| C16 | C17 | H11 | 119.9° | 120.0° |
| C16 | C33 | C32 | 119.8° | 120.0° |
| C16 | C33 | H19 | 120.1° | 119.9° |
| N02 | C01 | H1 | 109.5° | 109.5° |
| N02 | C01 | H2 | 109.5° | 109.5° |
| N02 | C01 | H3 | 109.4° | 109.5° |
| C01 | N02 | H4 | 106.8° | 120.1° |
| C17 | C18 | C19 | 119.4° | 120.0° |
| C18 | C17 | H11 | 119.9° | 120.0° |
| C17 | C18 | H12 | 120.3° | 120.0° |
| C33 | C32 | C19 | 120.7° | 120.0° |
| C33 | C32 | H18 | 119.7° | 120.1° |
| C32 | C33 | H19 | 120.1° | 120.0° |
| C18 | C19 | C32 | 120.0° | 119.9° |
| C18 | C19 | N20 | 122.7° | 120.0° |
| C19 | C18 | H12 | 120.3° | 120.0° |
| C32 | C19 | N20 | 117.4° | 120.0° |
| C19 | C32 | H18 | 119.7° | 120.0° |
| C19 | N20 | C21 | 124.1° | 120.0° |
| C19 | N20 | H13 | 118.0° | 120.0° |
| C21 | N22 | C23 | 107.8° | 109.6° |
| N22 | C21 | N20 | 126.7° | 125.0° |
| N22 | C21 | N31 | 109.0° | 109.9° |
| N22 | C23 | C24 | 132.2° | 133.4° |
| N22 | C23 | C30 | 107.9° | 107.1° |
| N20 | C21 | N31 | 124.3° | 125.0° |
| C21 | N20 | H13 | 117.9° | 120.0° |
| C23 | C24 | C25 | 120.3° | 119.9° |
| C24 | C23 | C30 | 119.9° | 119.5° |
| C23 | C24 | H15 | 119.9° | 120.1° |
| C24 | C25 | C26 | 119.5° | 120.5° |
| C25 | C24 | H15 | 119.9° | 120.1° |
| C24 | C25 | H16 | 120.2° | 119.8° |
| C21 | N31 | C30 | 108.5° | 107.2° |
| C21 | N31 | H17 | 125.7° | 126.4° |
| C23 | C30 | N31 | 106.8° | 106.2° |
| C23 | C30 | C28 | 119.9° | 120.0° |
| C25 | C26 | C28 | 120.5° | 120.4° |
| C25 | C26 | F27 | 120.0° | 119.8° |
| C26 | C25 | H16 | 120.2° | 119.8° |
| N31 | C30 | C28 | 133.3° | 133.9° |
| C30 | N31 | H17 | 125.7° | 126.4° |
| C30 | C28 | C26 | 119.9° | 119.8° |
| C30 | C28 | F29 | 120.2° | 120.1° |
| C28 | C26 | F27 | 119.5° | 119.8° |
| C26 | C28 | F29 | 119.9° | 120.1° |
| H1 | C01 | H2 | 109.5° | 109.4° |
| H1 | C01 | H3 | 109.5° | 109.5° |
| H2 | C01 | H3 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C10 | C11 | C12 | H9 | 180.0° | 180.0° |
| C11 | C10 | C09 | H8 | 180.0° | 180.0° |
| C10 | C11 | C12 | N13 | 0.1° | 0.0° |
| C11 | C10 | C09 | C05 | 179.6° | 180.0° |
| C11 | C10 | C09 | C14 | 0.6° | 0.2° |
| C10 | C11 | C12 | H10 | 179.9° | 180.0° |
| C12 | C11 | C10 | C09 | 0.3° | 0.0° |
| C11 | C12 | N13 | H10 | 180.0° | 180.0° |
| C11 | C12 | N13 | C14 | 0.2° | 0.3° |
| C12 | C11 | C10 | H8 | 179.6° | 180.0° |
| C10 | C09 | C05 | C06 | 55.6° | 130.2° |
| C10 | C09 | C05 | C14 | 179.0° | 179.8° |
| C10 | C09 | C05 | C04 | 124.7° | 49.7° |
| C10 | C09 | C14 | N13 | 0.5° | 0.5° |
| C10 | C09 | C14 | O15 | 179.8° | 179.8° |
| C09 | C10 | C11 | H9 | 179.6° | 180.0° |
| C07 | C06 | C05 | H6 | 180.0° | 179.7° |
| C06 | C07 | N08 | H7 | 180.0° | 179.7° |
| C07 | C06 | C05 | C09 | 179.8° | 180.0° |
| C07 | C06 | C05 | C04 | 0.0° | 0.0° |
| C06 | C07 | N08 | C03 | 0.3° | 0.6° |
| C05 | C06 | C07 | N08 | 0.1° | 0.3° |
| C06 | C05 | C09 | C04 | 179.7° | 179.9° |
| C06 | C05 | C09 | C14 | 125.4° | 50.0° |
| C06 | C05 | C04 | C03 | 0.0° | 0.1° |
| C06 | C05 | C04 | H5 | 180.0° | 179.9° |
| C05 | C06 | C07 | H7 | 179.9° | 180.0° |
| C07 | N08 | C03 | C04 | 0.3° | 0.5° |
| C07 | N08 | C03 | N02 | 179.9° | 179.7° |
| N08 | C07 | C06 | H6 | 179.9° | 180.0° |
| C12 | N13 | C14 | C09 | 0.0° | 0.5° |
| C12 | N13 | C14 | O15 | 179.3° | 179.8° |
| N13 | C12 | C11 | H9 | 179.9° | 180.0° |
| C05 | C09 | C14 | N13 | 179.5° | 179.7° |
| C05 | C09 | C14 | O15 | 1.2° | 0.0° |
| C09 | C05 | C04 | C03 | 179.8° | 180.0° |
| C09 | C05 | C04 | H5 | 0.2° | 0.0° |
| C09 | C05 | C06 | H6 | 0.2° | 0.3° |
| C05 | C09 | C10 | H8 | 0.4° | 0.0° |
| C14 | C09 | C05 | C04 | 54.4° | 130.1° |
| C09 | C14 | N13 | O15 | 179.3° | 179.7° |
| C09 | C14 | O15 | C16 | 144.3° | 175.2° |
| C14 | C09 | C10 | H8 | 179.4° | 179.8° |
| C05 | C04 | C03 | N08 | 0.2° | 0.2° |
| C05 | C04 | C03 | H5 | 180.0° | 180.0° |
| C05 | C04 | C03 | N02 | 179.8° | 180.0° |
| C04 | C05 | C06 | H6 | 180.0° | 179.7° |
| N08 | C03 | C04 | N02 | 179.6° | 179.8° |
| N08 | C03 | N02 | C01 | 156.7° | 179.7° |
| N08 | C03 | N02 | H4 | 35.2° | 0.2° |
| N08 | C03 | C04 | H5 | 179.9° | 179.8° |
| C03 | N08 | C07 | H7 | 179.8° | 179.7° |
| N13 | C14 | O15 | C16 | 36.4° | 4.6° |
| C14 | N13 | C12 | H10 | 179.8° | 179.7° |
| C14 | O15 | C16 | C17 | 105.6° | 76.3° |
| C14 | O15 | C16 | C33 | 76.3° | 104.0° |
| C04 | C03 | N02 | C01 | 22.9° | 0.0° |
| C04 | C03 | N02 | H4 | 144.4° | 180.0° |
| O15 | C16 | C17 | C33 | 178.0° | 179.7° |
| O15 | C16 | C17 | C18 | 179.1° | 180.0° |
| O15 | C16 | C33 | C32 | 179.4° | 179.7° |
| O15 | C16 | C17 | H11 | 0.9° | 0.1° |
| O15 | C16 | C33 | H19 | 0.6° | 0.0° |
| C03 | N02 | C01 | H4 | 121.5° | 180.0° |
| C03 | N02 | C01 | H1 | 180.0° | 59.9° |
| C03 | N02 | C01 | H2 | 60.0° | 60.0° |
| C03 | N02 | C01 | H3 | 60.0° | 180.0° |
| N02 | C03 | C04 | H5 | 0.3° | 0.0° |
| C16 | C17 | C18 | H11 | 180.0° | 179.9° |
| C17 | C16 | C33 | C32 | 1.3° | 0.6° |
| C16 | C17 | C18 | C19 | 0.4° | 0.1° |
| C16 | C17 | C18 | H12 | 179.6° | 179.9° |
| C17 | C16 | C33 | H19 | 178.7° | 179.7° |
| C33 | C16 | C17 | C18 | 1.1° | 0.3° |
| C16 | C33 | C32 | H19 | 180.0° | 179.7° |
| C16 | C33 | C32 | C19 | 0.8° | 0.6° |
| C33 | C16 | C17 | H11 | 178.9° | 179.7° |
| C16 | C33 | C32 | H18 | 179.2° | 179.8° |
| N02 | C01 | H1 | H2 | 120.0° | 120.0° |
| N02 | C01 | H1 | H3 | 120.0° | 120.1° |
| N02 | C01 | H2 | H3 | 120.0° | 120.0° |
| C17 | C18 | C19 | H12 | 180.0° | 180.0° |
| C17 | C18 | C19 | C32 | 0.1° | 0.0° |
| C17 | C18 | C19 | N20 | 179.9° | 180.0° |
| C33 | C32 | C19 | C18 | 0.1° | 0.3° |
| C33 | C32 | C19 | H18 | 180.0° | 179.7° |
| C33 | C32 | C19 | N20 | 179.7° | 179.7° |
| C18 | C19 | C32 | N20 | 179.8° | 180.0° |
| C18 | C19 | N20 | C21 | 11.3° | 30.6° |
| C19 | C18 | C17 | H11 | 179.6° | 180.0° |
| C18 | C19 | N20 | H13 | 168.7° | 149.5° |
| C18 | C19 | C32 | H18 | 179.9° | 180.0° |
| C32 | C19 | N20 | C21 | 168.4° | 149.4° |
| C32 | C19 | C18 | H12 | 179.9° | 179.9° |
| C32 | C19 | N20 | H13 | 11.5° | 30.5° |
| C19 | C32 | C33 | H19 | 179.2° | 179.7° |
| C19 | N20 | C21 | N22 | 31.6° | 2.4° |
| C19 | N20 | C21 | H13 | 180.0° | 179.9° |
| C19 | N20 | C21 | N31 | 149.2° | 177.3° |
| N20 | C19 | C18 | H12 | 0.2° | 0.0° |
| N20 | C19 | C32 | H18 | 0.3° | 0.0° |
| N22 | C21 | N20 | N31 | 179.2° | 179.7° |
| C21 | N22 | C23 | C24 | 179.5° | 180.0° |
| C21 | N22 | C23 | C30 | 0.5° | 0.0° |
| N22 | C21 | N31 | C30 | 0.4° | 0.4° |
| N22 | C21 | N20 | H13 | 148.4° | 177.7° |
| N22 | C21 | N31 | H17 | 179.6° | 179.7° |
| C23 | N22 | C21 | N20 | 179.9° | 180.0° |
| N22 | C23 | C24 | C30 | 180.0° | 180.0° |
| N22 | C23 | C24 | C25 | 179.8° | 180.0° |
| C23 | N22 | C21 | N31 | 0.6° | 0.3° |
| N22 | C23 | C30 | N31 | 0.3° | 0.2° |
| N22 | C23 | C30 | C28 | 179.8° | 180.0° |
| N22 | C23 | C24 | H15 | 0.3° | 0.1° |
| N20 | C21 | N31 | C30 | 179.7° | 179.8° |
| N20 | C21 | N31 | H17 | 0.3° | 0.1° |
| C23 | C24 | C25 | H15 | 180.0° | 179.9° |
| C23 | C24 | C25 | C26 | 0.1° | 0.0° |
| C24 | C23 | C30 | N31 | 179.7° | 179.7° |
| C24 | C23 | C30 | C28 | 0.2° | 0.0° |
| C23 | C24 | C25 | H16 | 179.9° | 180.0° |
| C25 | C24 | C23 | C30 | 0.2° | 0.1° |
| C24 | C25 | C26 | H16 | 180.0° | 180.0° |
| C24 | C25 | C26 | C28 | 0.0° | 0.0° |
| C24 | C25 | C26 | F27 | 179.8° | 179.9° |
| C21 | N31 | C30 | C23 | 0.1° | 0.4° |
| C21 | N31 | C30 | H17 | 180.0° | 179.9° |
| C21 | N31 | C30 | C28 | 179.8° | 179.9° |
| N31 | C21 | N20 | H13 | 30.8° | 2.6° |
| C23 | C30 | N31 | C28 | 179.9° | 179.7° |
| C23 | C30 | C28 | C26 | 0.0° | 0.0° |
| C23 | C30 | C28 | F29 | 179.9° | 180.0° |
| C30 | C23 | C24 | H15 | 179.7° | 179.9° |
| C23 | C30 | N31 | H17 | 179.9° | 179.7° |
| C25 | C26 | C28 | C30 | 0.1° | 0.0° |
| C25 | C26 | C28 | F27 | 179.9° | 179.9° |
| C25 | C26 | C28 | F29 | 180.0° | 179.9° |
| C26 | C25 | C24 | H15 | 179.8° | 179.9° |
| N31 | C30 | C28 | C26 | 179.9° | 179.7° |
| N31 | C30 | C28 | F29 | 0.3° | 0.3° |
| C30 | C28 | C26 | F29 | 179.9° | 180.0° |
| C30 | C28 | C26 | F27 | 179.8° | 179.9° |
| C28 | C30 | N31 | H17 | 0.2° | 0.0° |
| C28 | C26 | C25 | H16 | 179.9° | 180.0° |
| F27 | C26 | C28 | F29 | 0.1° | 0.0° |
| F27 | C26 | C25 | H16 | 0.2° | 0.1° |
| H1 | C01 | H2 | H3 | 120.0° | 120.0° |
| H1 | C01 | N02 | H4 | 58.5° | 120.0° |
| H2 | C01 | N02 | H4 | 178.6° | 120.0° |
| H3 | C01 | N02 | H4 | 61.5° | 0.0° |
| H6 | C06 | C07 | H7 | 0.1° | 0.3° |
| H8 | C10 | C11 | H9 | 0.4° | 0.0° |
| H9 | C11 | C12 | H10 | 0.1° | 0.0° |
| H11 | C17 | C18 | H12 | 0.4° | 0.0° |
| H15 | C24 | C25 | H16 | 0.1° | 0.1° |
| H18 | C32 | C33 | H19 | 0.8° | 0.1° |
