F1U
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C14 | C15 | doub | 1.38Å | 1.36Å | Aromatic |
| C14 | C13 | sing | 1.38Å | 1.36Å | Aromatic |
| C8 | C7 | sing | 1.53Å | 1.51Å | |
| C8 | C9 | sing | 1.53Å | 1.49Å | |
| C15 | C10 | sing | 1.38Å | 1.34Å | Aromatic |
| C7 | C6 | sing | 1.53Å | 1.51Å | |
| C13 | C12 | doub | 1.39Å | 1.35Å | Aromatic |
| C6 | C5 | sing | 1.53Å | 1.50Å | |
| C10 | C9 | sing | 1.51Å | 1.50Å | |
| C10 | C11 | doub | 1.38Å | 1.35Å | Aromatic |
| C9 | C4 | sing | 1.53Å | 1.50Å | |
| C9 | O18 | sing | 1.43Å | 1.36Å | |
| C12 | C11 | sing | 1.39Å | 1.36Å | Aromatic |
| C12 | O16 | sing | 1.36Å | 1.37Å | |
| C17 | O16 | sing | 1.43Å | 1.38Å | |
| C4 | C5 | sing | 1.53Å | 1.50Å | |
| C4 | C3 | sing | 1.53Å | 1.51Å | |
| C19 | N02 | sing | 1.47Å | 1.43Å | |
| C3 | N02 | sing | 1.47Å | 1.43Å | |
| N02 | C1 | sing | 1.47Å | 1.42Å | |
| C11 | H1 | sing | 1.08Å | 1.08Å | |
| C13 | H2 | sing | 1.08Å | 1.08Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C1 | H4 | sing | 1.09Å | 1.10Å | |
| C1 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C3 | H7 | sing | 1.09Å | 1.10Å | |
| C4 | H8 | sing | 1.09Å | 1.10Å | |
| C5 | H9 | sing | 1.09Å | 1.10Å | |
| C5 | H10 | sing | 1.09Å | 1.10Å | |
| C6 | H11 | sing | 1.09Å | 1.10Å | |
| C6 | H12 | sing | 1.09Å | 1.10Å | |
| C7 | H13 | sing | 1.09Å | 1.10Å | |
| C7 | H14 | sing | 1.09Å | 1.10Å | |
| C8 | H15 | sing | 1.09Å | 1.10Å | |
| C8 | H16 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.08Å | 1.08Å | |
| C15 | H18 | sing | 1.08Å | 1.08Å | |
| C17 | H19 | sing | 1.09Å | 1.10Å | |
| C17 | H20 | sing | 1.09Å | 1.10Å | |
| C17 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | H22 | sing | 1.09Å | 1.10Å | |
| C19 | H23 | sing | 1.09Å | 1.10Å | |
| C19 | H24 | sing | 1.09Å | 1.10Å | |
| O18 | H26 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C15 | C14 | C13 | 120.4° | 120.0° |
| C14 | C15 | C10 | 119.7° | 120.1° |
| C15 | C14 | H17 | 119.8° | 120.0° |
| C14 | C15 | H18 | 120.1° | 119.9° |
| C14 | C13 | C12 | 119.1° | 120.0° |
| C14 | C13 | H2 | 120.4° | 120.0° |
| C13 | C14 | H17 | 119.8° | 120.0° |
| C7 | C8 | C9 | 108.7° | 109.4° |
| C8 | C7 | C6 | 107.8° | 109.5° |
| C8 | C7 | H13 | 109.9° | 109.5° |
| C8 | C7 | H14 | 109.9° | 109.4° |
| C7 | C8 | H15 | 109.7° | 109.5° |
| C7 | C8 | H16 | 109.7° | 109.4° |
| C8 | C9 | C10 | 106.7° | 109.5° |
| C8 | C9 | C4 | 110.5° | 109.5° |
| C8 | C9 | O18 | 104.6° | 109.5° |
| C9 | C8 | H15 | 109.7° | 109.5° |
| C9 | C8 | H16 | 109.7° | 109.5° |
| C15 | C10 | C9 | 119.9° | 120.0° |
| C15 | C10 | C11 | 120.3° | 120.0° |
| C10 | C15 | H18 | 120.1° | 119.9° |
| C7 | C6 | C5 | 107.7° | 109.5° |
| C7 | C6 | H11 | 109.9° | 109.5° |
| C7 | C6 | H12 | 109.9° | 109.5° |
| C6 | C7 | H13 | 109.9° | 109.5° |
| C6 | C7 | H14 | 109.9° | 109.5° |
| C13 | C12 | C11 | 120.5° | 119.9° |
| C13 | C12 | O16 | 120.7° | 120.1° |
| C12 | C13 | H2 | 120.4° | 120.1° |
| C6 | C5 | C4 | 109.4° | 109.5° |
| C6 | C5 | H9 | 109.5° | 109.5° |
| C6 | C5 | H10 | 109.5° | 109.5° |
| C5 | C6 | H11 | 109.9° | 109.4° |
| C5 | C6 | H12 | 109.9° | 109.5° |
| C9 | C10 | C11 | 119.8° | 120.0° |
| C10 | C9 | C4 | 114.4° | 109.4° |
| C10 | C9 | O18 | 109.9° | 109.5° |
| C10 | C11 | C12 | 119.9° | 119.9° |
| C10 | C11 | H1 | 120.1° | 120.0° |
| C4 | C9 | O18 | 110.2° | 109.5° |
| C9 | C4 | C5 | 104.6° | 109.4° |
| C9 | C4 | C3 | 108.8° | 109.4° |
| C9 | C4 | H8 | 112.2° | 109.4° |
| C9 | O18 | H26 | 109.5° | 114.0° |
| C11 | C12 | O16 | 118.8° | 120.0° |
| C12 | C11 | H1 | 120.1° | 120.0° |
| C12 | O16 | C17 | 114.3° | 117.0° |
| O16 | C17 | H19 | 109.5° | 109.4° |
| O16 | C17 | H20 | 109.5° | 109.5° |
| O16 | C17 | H21 | 109.5° | 109.5° |
| C5 | C4 | C3 | 106.6° | 109.5° |
| C5 | C4 | H8 | 112.2° | 109.5° |
| C4 | C5 | H9 | 109.5° | 109.4° |
| C4 | C5 | H10 | 109.5° | 109.4° |
| C4 | C3 | N02 | 115.4° | 109.4° |
| C4 | C3 | H6 | 108.0° | 109.5° |
| C4 | C3 | H7 | 108.0° | 109.5° |
| C3 | C4 | H8 | 112.0° | 109.5° |
| C19 | N02 | C3 | 112.8° | 111.0° |
| C19 | N02 | C1 | 105.5° | 111.0° |
| N02 | C19 | H22 | 109.5° | 109.5° |
| N02 | C19 | H23 | 109.4° | 109.5° |
| N02 | C19 | H24 | 109.4° | 109.4° |
| C3 | N02 | C1 | 104.0° | 111.0° |
| N02 | C3 | H6 | 108.0° | 109.5° |
| N02 | C3 | H7 | 108.0° | 109.5° |
| N02 | C1 | H3 | 109.5° | 109.5° |
| N02 | C1 | H4 | 109.5° | 109.5° |
| N02 | C1 | H5 | 109.5° | 109.5° |
| H3 | C1 | H4 | 109.5° | 109.5° |
| H3 | C1 | H5 | 109.5° | 109.4° |
| H4 | C1 | H5 | 109.5° | 109.4° |
| H6 | C3 | H7 | 109.5° | 109.5° |
| H9 | C5 | H10 | 109.5° | 109.5° |
| H11 | C6 | H12 | 109.5° | 109.5° |
| H13 | C7 | H14 | 109.5° | 109.4° |
| H15 | C8 | H16 | 109.4° | 109.5° |
| H19 | C17 | H20 | 109.5° | 109.5° |
| H19 | C17 | H21 | 109.5° | 109.5° |
| H20 | C17 | H21 | 109.5° | 109.5° |
| H22 | C19 | H23 | 109.5° | 109.4° |
| H22 | C19 | H24 | 109.5° | 109.5° |
| H23 | C19 | H24 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C15 | C14 | C13 | H17 | 180.0° | 179.5° |
| C14 | C15 | C10 | H18 | 180.0° | 179.5° |
| C15 | C14 | C13 | C12 | 0.4° | 0.2° |
| C14 | C15 | C10 | C9 | 179.2° | 179.7° |
| C14 | C15 | C10 | C11 | 1.3° | 0.5° |
| C15 | C14 | C13 | H2 | 179.6° | 179.7° |
| C13 | C14 | C15 | C10 | 0.9° | 0.5° |
| C14 | C13 | C12 | H2 | 180.0° | 180.0° |
| C14 | C13 | C12 | C11 | 0.4° | 0.0° |
| C14 | C13 | C12 | O16 | 180.0° | 180.0° |
| C13 | C14 | C15 | H18 | 179.1° | 180.0° |
| C7 | C8 | C9 | H15 | 119.9° | 120.0° |
| C7 | C8 | C9 | H16 | 119.9° | 119.9° |
| C8 | C7 | C6 | H13 | 119.7° | 120.0° |
| C8 | C7 | C6 | H14 | 119.8° | 120.0° |
| C8 | C7 | C6 | C5 | 61.6° | 60.0° |
| C7 | C8 | C9 | C10 | 171.7° | 180.0° |
| C7 | C8 | C9 | C4 | 63.3° | 60.0° |
| C7 | C8 | C9 | O18 | 55.3° | 60.0° |
| C8 | C7 | C6 | H11 | 58.1° | 180.0° |
| C8 | C7 | C6 | H12 | 178.7° | 60.0° |
| C8 | C7 | H13 | H14 | 120.8° | 119.9° |
| C7 | C8 | H15 | H16 | 120.4° | 120.0° |
| C8 | C9 | C10 | C15 | 62.6° | 90.3° |
| C9 | C8 | C7 | C6 | 60.6° | 60.0° |
| C8 | C9 | C10 | C4 | 122.6° | 120.0° |
| C8 | C9 | C10 | O18 | 112.8° | 120.0° |
| C8 | C9 | C10 | C11 | 115.2° | 90.0° |
| C8 | C9 | C4 | O18 | 115.1° | 120.0° |
| C8 | C9 | C4 | C5 | 63.6° | 60.0° |
| C8 | C9 | C4 | C3 | 177.2° | 180.0° |
| C8 | C9 | C4 | H8 | 58.3° | 60.0° |
| C9 | C8 | C7 | H13 | 179.7° | 60.1° |
| C9 | C8 | C7 | H14 | 59.2° | 180.0° |
| C9 | C8 | H15 | H16 | 120.3° | 120.1° |
| C8 | C9 | O18 | H26 | 180.0° | 60.0° |
| C15 | C10 | C9 | C11 | 177.9° | 179.7° |
| C15 | C10 | C9 | C4 | 60.0° | 29.7° |
| C15 | C10 | C9 | O18 | 175.4° | 149.7° |
| C15 | C10 | C11 | C12 | 1.3° | 0.3° |
| C15 | C10 | C11 | H1 | 178.7° | 179.7° |
| C10 | C15 | C14 | H17 | 179.1° | 180.0° |
| C7 | C6 | C5 | H11 | 119.7° | 120.0° |
| C7 | C6 | C5 | H12 | 119.7° | 120.1° |
| C7 | C6 | C5 | C4 | 65.6° | 60.0° |
| C7 | C6 | C5 | H9 | 174.4° | 60.0° |
| C7 | C6 | C5 | H10 | 54.4° | 180.0° |
| C7 | C6 | H11 | H12 | 120.8° | 120.1° |
| C6 | C7 | H13 | H14 | 120.8° | 120.1° |
| C6 | C7 | C8 | H15 | 179.5° | 180.0° |
| C6 | C7 | C8 | H16 | 59.3° | 60.0° |
| C13 | C12 | C11 | C10 | 0.8° | 0.0° |
| C13 | C12 | C11 | O16 | 179.7° | 180.0° |
| C13 | C12 | O16 | C17 | 2.2° | 0.0° |
| C13 | C12 | C11 | H1 | 179.2° | 180.0° |
| C12 | C13 | C14 | H17 | 179.6° | 179.7° |
| C6 | C5 | C4 | C9 | 64.5° | 60.0° |
| C6 | C5 | C4 | H9 | 120.0° | 120.0° |
| C6 | C5 | C4 | H10 | 120.0° | 120.0° |
| C6 | C5 | C4 | C3 | 179.6° | 180.0° |
| C6 | C5 | C4 | H8 | 57.4° | 60.0° |
| C6 | C5 | H9 | H10 | 120.0° | 120.1° |
| C5 | C6 | H11 | H12 | 120.8° | 120.0° |
| C5 | C6 | C7 | H13 | 178.7° | 60.0° |
| C5 | C6 | C7 | H14 | 58.2° | 180.0° |
| C10 | C9 | C4 | O18 | 124.5° | 120.0° |
| C9 | C10 | C11 | C12 | 179.1° | 180.0° |
| C10 | C9 | C4 | C5 | 176.0° | 180.0° |
| C10 | C9 | C4 | C3 | 62.4° | 60.0° |
| C9 | C10 | C11 | H1 | 0.9° | 0.0° |
| C10 | C9 | C4 | H8 | 62.1° | 60.0° |
| C10 | C9 | C8 | H15 | 51.8° | 60.0° |
| C10 | C9 | C8 | H16 | 68.4° | 60.0° |
| C9 | C10 | C15 | H18 | 0.8° | 0.2° |
| C10 | C9 | O18 | H26 | 65.8° | 60.0° |
| C11 | C10 | C9 | C4 | 122.2° | 150.0° |
| C11 | C10 | C9 | O18 | 2.4° | 30.0° |
| C10 | C11 | C12 | H1 | 180.0° | 180.0° |
| C10 | C11 | C12 | O16 | 179.5° | 180.0° |
| C11 | C10 | C15 | H18 | 178.6° | 180.0° |
| C9 | C4 | C5 | C3 | 115.1° | 119.9° |
| C9 | C4 | C5 | H8 | 121.9° | 120.0° |
| C9 | C4 | C3 | H8 | 124.6° | 120.0° |
| C9 | C4 | C3 | N02 | 178.7° | 176.3° |
| C9 | C4 | C3 | H6 | 60.4° | 63.8° |
| C9 | C4 | C3 | H7 | 57.8° | 56.3° |
| C9 | C4 | C5 | H9 | 175.5° | 60.0° |
| C9 | C4 | C5 | H10 | 55.5° | 180.0° |
| C4 | C9 | C8 | H15 | 176.8° | 180.0° |
| C4 | C9 | C8 | H16 | 56.6° | 60.0° |
| C4 | C9 | O18 | H26 | 61.2° | 180.0° |
| O18 | C9 | C4 | C5 | 51.5° | 60.0° |
| O18 | C9 | C4 | C3 | 62.1° | 60.0° |
| O18 | C9 | C4 | H8 | 173.4° | 180.0° |
| O18 | C9 | C8 | H15 | 64.6° | 60.0° |
| O18 | C9 | C8 | H16 | 175.2° | 180.0° |
| C11 | C12 | O16 | C17 | 177.5° | 180.0° |
| C11 | C12 | C13 | H2 | 179.6° | 180.0° |
| O16 | C12 | C11 | H1 | 0.5° | 0.0° |
| O16 | C12 | C13 | H2 | 0.0° | 0.0° |
| C12 | O16 | C17 | H19 | 180.0° | 60.0° |
| C12 | O16 | C17 | H20 | 60.0° | 60.0° |
| C12 | O16 | C17 | H21 | 60.0° | 179.9° |
| O16 | C17 | H19 | H20 | 120.0° | 120.0° |
| O16 | C17 | H19 | H21 | 120.0° | 120.0° |
| O16 | C17 | H20 | H21 | 120.0° | 120.0° |
| C5 | C4 | C3 | H8 | 123.1° | 120.1° |
| C5 | C4 | C3 | N02 | 69.0° | 63.8° |
| C5 | C4 | C3 | H6 | 51.8° | 56.2° |
| C5 | C4 | C3 | H7 | 170.1° | 176.3° |
| C4 | C5 | H9 | H10 | 120.1° | 119.9° |
| C4 | C5 | C6 | H11 | 54.1° | 180.0° |
| C4 | C5 | C6 | H12 | 174.7° | 60.0° |
| C4 | C3 | N02 | C19 | 4.8° | 164.2° |
| C4 | C3 | N02 | H6 | 120.9° | 120.0° |
| C4 | C3 | N02 | H7 | 120.9° | 120.0° |
| C4 | C3 | N02 | C1 | 118.6° | 71.9° |
| C4 | C3 | H6 | H7 | 117.3° | 120.0° |
| C3 | C4 | C5 | H9 | 60.4° | 59.9° |
| C3 | C4 | C5 | H10 | 59.6° | 60.0° |
| C19 | N02 | C3 | C1 | 113.8° | 123.9° |
| C19 | N02 | C1 | H3 | 180.0° | 176.1° |
| C19 | N02 | C1 | H4 | 60.0° | 56.0° |
| C19 | N02 | C1 | H5 | 60.0° | 64.0° |
| C19 | N02 | C3 | H6 | 125.7° | 44.2° |
| C19 | N02 | C3 | H7 | 116.0° | 75.9° |
| N02 | C19 | H22 | H23 | 120.0° | 120.0° |
| N02 | C19 | H22 | H24 | 120.0° | 120.0° |
| N02 | C19 | H23 | H24 | 120.0° | 120.0° |
| C3 | N02 | C1 | H3 | 61.1° | 60.0° |
| C3 | N02 | C1 | H4 | 58.9° | 180.0° |
| C3 | N02 | C1 | H5 | 178.9° | 60.0° |
| N02 | C3 | H6 | H7 | 117.3° | 120.0° |
| N02 | C3 | C4 | H8 | 54.1° | 56.3° |
| C3 | N02 | C19 | H22 | 180.0° | 64.9° |
| C3 | N02 | C19 | H23 | 60.0° | 175.1° |
| C3 | N02 | C19 | H24 | 60.0° | 55.1° |
| N02 | C1 | H3 | H4 | 120.0° | 120.1° |
| N02 | C1 | H3 | H5 | 120.0° | 120.0° |
| N02 | C1 | H4 | H5 | 120.0° | 120.0° |
| C1 | N02 | C3 | H6 | 120.5° | 168.1° |
| C1 | N02 | C3 | H7 | 2.3° | 48.1° |
| C1 | N02 | C19 | H22 | 67.1° | 59.0° |
| C1 | N02 | C19 | H23 | 52.9° | 61.0° |
| C1 | N02 | C19 | H24 | 172.9° | 179.1° |
| H2 | C13 | C14 | H17 | 0.4° | 0.2° |
| H3 | C1 | H4 | H5 | 120.0° | 119.9° |
| H6 | C3 | C4 | H8 | 175.0° | 176.2° |
| H7 | C3 | C4 | H8 | 66.8° | 63.7° |
| H8 | C4 | C5 | H9 | 62.6° | 180.0° |
| H8 | C4 | C5 | H10 | 177.4° | 60.0° |
| H9 | C5 | C6 | H11 | 65.9° | 60.0° |
| H9 | C5 | C6 | H12 | 54.7° | 180.0° |
| H10 | C5 | C6 | H11 | 174.2° | 60.0° |
| H10 | C5 | C6 | H12 | 65.3° | 59.9° |
| H11 | C6 | C7 | H13 | 61.6° | 60.0° |
| H11 | C6 | C7 | H14 | 177.9° | 60.0° |
| H12 | C6 | C7 | H13 | 59.0° | 180.0° |
| H12 | C6 | C7 | H14 | 61.5° | 60.0° |
| H13 | C7 | C8 | H15 | 59.8° | 59.9° |
| H13 | C7 | C8 | H16 | 60.4° | 180.0° |
| H14 | C7 | C8 | H15 | 60.7° | 60.0° |
| H14 | C7 | C8 | H16 | 179.0° | 60.0° |
| H17 | C14 | C15 | H18 | 1.0° | 0.5° |
| H19 | C17 | H20 | H21 | 120.0° | 120.0° |
| H22 | C19 | H23 | H24 | 120.0° | 120.0° |
