C9F
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C20 | C18 | sing | 1.51Å | 1.54Å | |
| C18 | O19 | doub | 1.21Å | 1.22Å | |
| C18 | O17 | sing | 1.34Å | 1.39Å | |
| O17 | C16 | sing | 1.45Å | 1.39Å | |
| O01 | C02 | doub | 1.21Å | 1.17Å | |
| C16 | C02 | sing | 1.50Å | 1.56Å | |
| C16 | C07 | sing | 1.54Å | 1.55Å | |
| C10 | C09 | doub | 1.38Å | 1.38Å | Aromatic |
| C10 | C11 | sing | 1.39Å | 1.39Å | Aromatic |
| O12 | C11 | sing | 1.36Å | 1.45Å | |
| O12 | C13 | sing | 1.43Å | 1.43Å | |
| C09 | C08 | sing | 1.38Å | 1.39Å | Aromatic |
| C11 | C14 | doub | 1.39Å | 1.40Å | Aromatic |
| C28 | N27 | sing | 1.47Å | 1.43Å | |
| C02 | N03 | sing | 1.34Å | 1.48Å | |
| N27 | C29 | sing | 1.47Å | 1.45Å | |
| N27 | C26 | sing | 1.47Å | 1.51Å | |
| C08 | C07 | sing | 1.51Å | 1.58Å | |
| C08 | C15 | doub | 1.38Å | 1.40Å | Aromatic |
| C14 | C15 | sing | 1.38Å | 1.38Å | Aromatic |
| C07 | S06 | sing | 1.82Å | 1.79Å | |
| N03 | C25 | sing | 1.46Å | 1.49Å | |
| N03 | C04 | sing | 1.40Å | 1.53Å | |
| C26 | C25 | sing | 1.53Å | 1.52Å | |
| S06 | C05 | sing | 1.76Å | 1.80Å | |
| C04 | C05 | doub | 1.39Å | 1.39Å | Aromatic |
| C04 | C24 | sing | 1.39Å | 1.44Å | Aromatic |
| C05 | C21 | sing | 1.39Å | 1.39Å | Aromatic |
| C24 | C23 | doub | 1.38Å | 1.38Å | Aromatic |
| C21 | C22 | doub | 1.38Å | 1.43Å | Aromatic |
| C23 | C22 | sing | 1.38Å | 1.40Å | Aromatic |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| C13 | H2 | sing | 1.09Å | 1.10Å | |
| C13 | H3 | sing | 1.09Å | 1.10Å | |
| C13 | H4 | sing | 1.09Å | 1.10Å | |
| C15 | H5 | sing | 1.08Å | 1.08Å | |
| C20 | H6 | sing | 1.09Å | 1.10Å | |
| C20 | H7 | sing | 1.09Å | 1.10Å | |
| C20 | H8 | sing | 1.09Å | 1.10Å | |
| C21 | H9 | sing | 1.08Å | 1.08Å | |
| C22 | H10 | sing | 1.08Å | 1.08Å | |
| C24 | H11 | sing | 1.08Å | 1.08Å | |
| C26 | H12 | sing | 1.09Å | 1.10Å | |
| C26 | H13 | sing | 1.09Å | 1.10Å | |
| C28 | H14 | sing | 1.09Å | 1.10Å | |
| C28 | H15 | sing | 1.09Å | 1.10Å | |
| C28 | H16 | sing | 1.09Å | 1.10Å | |
| C07 | H17 | sing | 1.09Å | 1.10Å | |
| C09 | H18 | sing | 1.08Å | 1.08Å | |
| C14 | H19 | sing | 1.08Å | 1.08Å | |
| C16 | H20 | sing | 1.09Å | 1.10Å | |
| C23 | H21 | sing | 1.08Å | 1.08Å | |
| C25 | H22 | sing | 1.09Å | 1.10Å | |
| C25 | H23 | sing | 1.09Å | 1.10Å | |
| C29 | H25 | sing | 1.09Å | 1.10Å | |
| C29 | H26 | sing | 1.09Å | 1.10Å | |
| C29 | H27 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C20 | C18 | O19 | 119.9° | 120.0° |
| C20 | C18 | O17 | 120.1° | 120.0° |
| C18 | C20 | H6 | 109.5° | 109.5° |
| C18 | C20 | H7 | 109.5° | 109.5° |
| C18 | C20 | H8 | 109.4° | 109.5° |
| O19 | C18 | O17 | 120.0° | 120.0° |
| C18 | O17 | C16 | 113.3° | 117.0° |
| O17 | C16 | C02 | 107.3° | 109.3° |
| O17 | C16 | C07 | 107.7° | 109.3° |
| O17 | C16 | H20 | 108.6° | 109.2° |
| O01 | C02 | C16 | 114.2° | 119.4° |
| O01 | C02 | N03 | 117.5° | 119.5° |
| C02 | C16 | C07 | 119.7° | 110.5° |
| C16 | C02 | N03 | 128.4° | 121.1° |
| C02 | C16 | H20 | 106.5° | 109.3° |
| C16 | C07 | C08 | 110.8° | 109.9° |
| C16 | C07 | S06 | 112.0° | 107.5° |
| C16 | C07 | H17 | 108.8° | 109.9° |
| C07 | C16 | H20 | 106.7° | 109.3° |
| C09 | C10 | C11 | 119.7° | 119.9° |
| C10 | C09 | C08 | 120.4° | 120.0° |
| C09 | C10 | H1 | 120.1° | 120.0° |
| C10 | C09 | H18 | 119.8° | 120.0° |
| C10 | C11 | O12 | 119.2° | 120.1° |
| C10 | C11 | C14 | 120.2° | 119.9° |
| C11 | C10 | H1 | 120.1° | 120.0° |
| C11 | O12 | C13 | 113.6° | 117.0° |
| O12 | C11 | C14 | 120.6° | 120.0° |
| O12 | C13 | H2 | 109.5° | 109.5° |
| O12 | C13 | H3 | 109.5° | 109.5° |
| O12 | C13 | H4 | 109.5° | 109.4° |
| C09 | C08 | C07 | 118.5° | 119.9° |
| C09 | C08 | C15 | 120.0° | 120.1° |
| C08 | C09 | H18 | 119.8° | 119.9° |
| C11 | C14 | C15 | 120.1° | 120.0° |
| C11 | C14 | H19 | 120.0° | 120.0° |
| C28 | N27 | C29 | 109.2° | 111.0° |
| C28 | N27 | C26 | 109.1° | 111.0° |
| N27 | C28 | H14 | 109.5° | 109.5° |
| N27 | C28 | H15 | 109.5° | 109.5° |
| N27 | C28 | H16 | 109.5° | 109.5° |
| C02 | N03 | C25 | 113.2° | 120.0° |
| C02 | N03 | C04 | 137.0° | 119.9° |
| C29 | N27 | C26 | 109.9° | 111.0° |
| N27 | C29 | H25 | 109.5° | 109.4° |
| N27 | C29 | H26 | 109.5° | 109.5° |
| N27 | C29 | H27 | 109.5° | 109.5° |
| N27 | C26 | C25 | 110.6° | 109.5° |
| N27 | C26 | H12 | 109.2° | 109.4° |
| N27 | C26 | H13 | 109.2° | 109.5° |
| C07 | C08 | C15 | 121.5° | 119.9° |
| C08 | C07 | S06 | 110.3° | 109.8° |
| C08 | C07 | H17 | 108.5° | 109.8° |
| C08 | C15 | C14 | 119.6° | 120.0° |
| C08 | C15 | H5 | 120.2° | 120.0° |
| C14 | C15 | H5 | 120.2° | 120.0° |
| C15 | C14 | H19 | 119.9° | 120.0° |
| C07 | S06 | C05 | 110.9° | 102.4° |
| S06 | C07 | H17 | 106.2° | 109.9° |
| C25 | N03 | C04 | 109.8° | 120.0° |
| N03 | C25 | C26 | 110.4° | 109.5° |
| N03 | C25 | H22 | 109.3° | 109.5° |
| N03 | C25 | H23 | 109.2° | 109.5° |
| N03 | C04 | C05 | 125.8° | 119.5° |
| N03 | C04 | C24 | 115.7° | 120.6° |
| C25 | C26 | H12 | 109.2° | 109.5° |
| C25 | C26 | H13 | 109.2° | 109.5° |
| C26 | C25 | H22 | 109.2° | 109.5° |
| C26 | C25 | H23 | 109.2° | 109.4° |
| S06 | C05 | C04 | 122.0° | 119.4° |
| S06 | C05 | C21 | 117.7° | 120.6° |
| C05 | C04 | C24 | 118.4° | 119.9° |
| C04 | C05 | C21 | 120.3° | 120.1° |
| C04 | C24 | C23 | 121.4° | 119.7° |
| C04 | C24 | H11 | 119.3° | 120.1° |
| C05 | C21 | C22 | 120.7° | 119.7° |
| C05 | C21 | H9 | 119.6° | 120.2° |
| C24 | C23 | C22 | 119.6° | 120.3° |
| C23 | C24 | H11 | 119.3° | 120.1° |
| C24 | C23 | H21 | 120.2° | 119.8° |
| C21 | C22 | C23 | 119.5° | 120.3° |
| C22 | C21 | H9 | 119.7° | 120.1° |
| C21 | C22 | H10 | 120.3° | 119.9° |
| C23 | C22 | H10 | 120.3° | 119.8° |
| C22 | C23 | H21 | 120.2° | 119.9° |
| H2 | C13 | H3 | 109.5° | 109.6° |
| H2 | C13 | H4 | 109.4° | 109.5° |
| H3 | C13 | H4 | 109.5° | 109.4° |
| H6 | C20 | H7 | 109.5° | 109.4° |
| H6 | C20 | H8 | 109.4° | 109.5° |
| H7 | C20 | H8 | 109.5° | 109.5° |
| H12 | C26 | H13 | 109.5° | 109.4° |
| H14 | C28 | H15 | 109.5° | 109.4° |
| H14 | C28 | H16 | 109.5° | 109.5° |
| H15 | C28 | H16 | 109.4° | 109.5° |
| H22 | C25 | H23 | 109.5° | 109.5° |
| H25 | C29 | H26 | 109.5° | 109.5° |
| H25 | C29 | H27 | 109.5° | 109.5° |
| H26 | C29 | H27 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C20 | C18 | O19 | O17 | 179.7° | 179.9° |
| C20 | C18 | O17 | C16 | 146.9° | 180.0° |
| C18 | C20 | H6 | H7 | 120.0° | 119.9° |
| C18 | C20 | H6 | H8 | 120.0° | 120.1° |
| C18 | C20 | H7 | H8 | 120.0° | 120.1° |
| O19 | C18 | O17 | C16 | 32.8° | 0.0° |
| O19 | C18 | C20 | H6 | 0.0° | 0.1° |
| O19 | C18 | C20 | H7 | 120.0° | 120.0° |
| O19 | C18 | C20 | H8 | 120.0° | 120.0° |
| C18 | O17 | C16 | C02 | 92.5° | 90.0° |
| C18 | O17 | C16 | C07 | 137.4° | 148.9° |
| O17 | C18 | C20 | H6 | 179.7° | 180.0° |
| O17 | C18 | C20 | H7 | 59.7° | 60.1° |
| O17 | C18 | C20 | H8 | 60.3° | 60.0° |
| C18 | O17 | C16 | H20 | 22.3° | 29.5° |
| O17 | C16 | C02 | O01 | 46.1° | 31.0° |
| O17 | C16 | C02 | C07 | 123.1° | 120.3° |
| O17 | C16 | C02 | H20 | 116.1° | 119.5° |
| O17 | C16 | C07 | H20 | 116.4° | 119.4° |
| O17 | C16 | C02 | N03 | 134.5° | 148.9° |
| O17 | C16 | C07 | C08 | 55.3° | 42.8° |
| O17 | C16 | C07 | S06 | 179.0° | 162.3° |
| O17 | C16 | C07 | H17 | 63.9° | 78.2° |
| O01 | C02 | C16 | N03 | 179.4° | 179.9° |
| O01 | C02 | C16 | C07 | 169.1° | 89.2° |
| O01 | C02 | N03 | C25 | 0.4° | 10.5° |
| O01 | C02 | N03 | C04 | 179.9° | 169.5° |
| O01 | C02 | C16 | H20 | 70.0° | 150.5° |
| C02 | C16 | C07 | H20 | 120.8° | 120.3° |
| C02 | C16 | C07 | C08 | 67.6° | 77.5° |
| C02 | C16 | C07 | S06 | 56.1° | 42.0° |
| C16 | C02 | N03 | C25 | 179.8° | 169.4° |
| C16 | C02 | N03 | C04 | 0.7° | 10.6° |
| C02 | C16 | C07 | H17 | 173.3° | 161.5° |
| C16 | C07 | C08 | C09 | 136.6° | 109.4° |
| C07 | C16 | C02 | N03 | 11.5° | 90.8° |
| C16 | C07 | C08 | S06 | 124.7° | 118.1° |
| C16 | C07 | C08 | H17 | 119.4° | 121.0° |
| C16 | C07 | C08 | C15 | 43.3° | 70.6° |
| C16 | C07 | S06 | H17 | 118.7° | 119.5° |
| C16 | C07 | S06 | C05 | 81.8° | 41.3° |
| C09 | C10 | C11 | H1 | 180.0° | 179.7° |
| C09 | C10 | C11 | O12 | 179.9° | 179.9° |
| C10 | C09 | C08 | H18 | 180.0° | 179.9° |
| C09 | C10 | C11 | C14 | 0.0° | 0.0° |
| C10 | C09 | C08 | C07 | 179.9° | 180.0° |
| C10 | C09 | C08 | C15 | 0.0° | 0.0° |
| C10 | C11 | O12 | C14 | 179.9° | 179.9° |
| C10 | C11 | O12 | C13 | 52.1° | 180.0° |
| C11 | C10 | C09 | C08 | 0.0° | 0.0° |
| C10 | C11 | C14 | C15 | 0.0° | 0.0° |
| C11 | C10 | C09 | H18 | 180.0° | 180.0° |
| C10 | C11 | C14 | H19 | 180.0° | 180.0° |
| O12 | C11 | C14 | C15 | 179.9° | 179.9° |
| O12 | C11 | C10 | H1 | 0.1° | 0.4° |
| C11 | O12 | C13 | H2 | 180.0° | 60.1° |
| C11 | O12 | C13 | H3 | 60.0° | 60.0° |
| C11 | O12 | C13 | H4 | 60.0° | 179.9° |
| O12 | C11 | C14 | H19 | 0.1° | 0.1° |
| C13 | O12 | C11 | C14 | 127.7° | 0.1° |
| O12 | C13 | H2 | H3 | 120.0° | 120.0° |
| O12 | C13 | H2 | H4 | 120.0° | 119.9° |
| O12 | C13 | H3 | H4 | 120.0° | 119.9° |
| C09 | C08 | C07 | C15 | 179.9° | 180.0° |
| C09 | C08 | C15 | C14 | 0.0° | 0.0° |
| C09 | C08 | C07 | S06 | 98.7° | 132.6° |
| C08 | C09 | C10 | H1 | 180.0° | 179.7° |
| C09 | C08 | C15 | H5 | 180.0° | 180.0° |
| C09 | C08 | C07 | H17 | 17.2° | 11.7° |
| C11 | C14 | C15 | C08 | 0.0° | 0.0° |
| C11 | C14 | C15 | H19 | 180.0° | 180.0° |
| C14 | C11 | C10 | H1 | 180.0° | 179.7° |
| C11 | C14 | C15 | H5 | 180.0° | 180.0° |
| C28 | N27 | C29 | C26 | 119.6° | 124.0° |
| C28 | N27 | C26 | C25 | 176.2° | 66.0° |
| C28 | N27 | C26 | H12 | 56.1° | 54.0° |
| C28 | N27 | C26 | H13 | 63.6° | 173.9° |
| N27 | C28 | H14 | H15 | 120.0° | 120.0° |
| N27 | C28 | H14 | H16 | 120.0° | 120.0° |
| N27 | C28 | H15 | H16 | 120.0° | 120.0° |
| C28 | N27 | C29 | H25 | 180.0° | 63.9° |
| C28 | N27 | C29 | H26 | 60.0° | 176.0° |
| C28 | N27 | C29 | H27 | 60.0° | 56.0° |
| C02 | N03 | C25 | C04 | 179.6° | 180.0° |
| C02 | N03 | C25 | C26 | 59.2° | 90.0° |
| C02 | N03 | C04 | C05 | 19.7° | 50.4° |
| C02 | N03 | C04 | C24 | 161.5° | 130.1° |
| N03 | C02 | C16 | H20 | 109.4° | 29.4° |
| C02 | N03 | C25 | H22 | 60.9° | 30.0° |
| C02 | N03 | C25 | H23 | 179.3° | 150.0° |
| C29 | N27 | C26 | C25 | 64.1° | 170.0° |
| C29 | N27 | C26 | H12 | 175.8° | 70.0° |
| C29 | N27 | C26 | H13 | 56.1° | 49.9° |
| C29 | N27 | C28 | H14 | 180.0° | 60.0° |
| C29 | N27 | C28 | H15 | 60.0° | 180.0° |
| C29 | N27 | C28 | H16 | 60.0° | 60.0° |
| N27 | C29 | H25 | H26 | 120.0° | 120.0° |
| N27 | C29 | H25 | H27 | 120.0° | 120.0° |
| N27 | C29 | H26 | H27 | 120.0° | 120.0° |
| N27 | C26 | C25 | N03 | 110.3° | 180.0° |
| N27 | C26 | C25 | H12 | 120.2° | 120.0° |
| N27 | C26 | C25 | H13 | 120.2° | 120.1° |
| N27 | C26 | H12 | H13 | 119.4° | 120.0° |
| C26 | N27 | C28 | H14 | 59.8° | 176.0° |
| C26 | N27 | C28 | H15 | 179.9° | 56.0° |
| C26 | N27 | C28 | H16 | 60.2° | 64.0° |
| N27 | C26 | C25 | H22 | 9.8° | 59.9° |
| N27 | C26 | C25 | H23 | 129.5° | 60.1° |
| C26 | N27 | C29 | H25 | 60.4° | 60.1° |
| C26 | N27 | C29 | H26 | 59.7° | 59.9° |
| C26 | N27 | C29 | H27 | 179.6° | 180.0° |
| C07 | C08 | C15 | C14 | 179.9° | 180.0° |
| C08 | C07 | S06 | H17 | 117.3° | 120.9° |
| C08 | C07 | S06 | C05 | 42.2° | 160.9° |
| C07 | C08 | C15 | H5 | 0.1° | 0.0° |
| C07 | C08 | C09 | H18 | 0.1° | 0.1° |
| C08 | C07 | C16 | H20 | 171.7° | 162.2° |
| C08 | C15 | C14 | H5 | 180.0° | 180.0° |
| C15 | C08 | C07 | S06 | 81.4° | 47.4° |
| C15 | C08 | C07 | H17 | 162.7° | 168.4° |
| C15 | C08 | C09 | H18 | 180.0° | 180.0° |
| C08 | C15 | C14 | H19 | 180.0° | 180.0° |
| C07 | S06 | C05 | C04 | 48.8° | 73.0° |
| C07 | S06 | C05 | C21 | 130.6° | 107.4° |
| S06 | C07 | C16 | H20 | 64.6° | 78.3° |
| N03 | C25 | C26 | H22 | 120.2° | 120.1° |
| N03 | C25 | C26 | H23 | 120.1° | 120.0° |
| C25 | N03 | C04 | C05 | 160.8° | 129.6° |
| C25 | N03 | C04 | C24 | 18.0° | 50.0° |
| N03 | C25 | C26 | H12 | 9.8° | 60.0° |
| N03 | C25 | C26 | H13 | 129.5° | 60.0° |
| N03 | C25 | H22 | H23 | 119.6° | 120.0° |
| C04 | N03 | C25 | C26 | 121.1° | 90.0° |
| N03 | C04 | C05 | S06 | 1.0° | 1.0° |
| N03 | C04 | C05 | C24 | 178.8° | 179.5° |
| N03 | C04 | C05 | C21 | 179.5° | 179.4° |
| N03 | C04 | C24 | C23 | 179.7° | 179.4° |
| N03 | C04 | C24 | H11 | 0.3° | 0.0° |
| C04 | N03 | C25 | H22 | 118.7° | 150.0° |
| C04 | N03 | C25 | H23 | 1.0° | 30.0° |
| C25 | C26 | H12 | H13 | 119.5° | 120.0° |
| C26 | C25 | H22 | H23 | 119.6° | 120.0° |
| S06 | C05 | C04 | C21 | 179.5° | 179.6° |
| S06 | C05 | C04 | C24 | 179.8° | 178.6° |
| S06 | C05 | C21 | C22 | 179.9° | 179.2° |
| S06 | C05 | C21 | H9 | 0.1° | 1.1° |
| C05 | S06 | C07 | H17 | 159.5° | 78.2° |
| C05 | C04 | C24 | C23 | 0.8° | 1.1° |
| C04 | C05 | C21 | C22 | 0.4° | 0.4° |
| C04 | C05 | C21 | H9 | 179.6° | 179.3° |
| C05 | C04 | C24 | H11 | 179.2° | 179.5° |
| C24 | C04 | C05 | C21 | 0.8° | 1.0° |
| C04 | C24 | C23 | H11 | 180.0° | 179.4° |
| C04 | C24 | C23 | C22 | 0.4° | 0.5° |
| C04 | C24 | C23 | H21 | 179.6° | 179.9° |
| C05 | C21 | C22 | H9 | 180.0° | 179.7° |
| C05 | C21 | C22 | C23 | 0.0° | 0.2° |
| C05 | C21 | C22 | H10 | 180.0° | 179.7° |
| C24 | C23 | C22 | C21 | 0.0° | 0.1° |
| C24 | C23 | C22 | H21 | 180.0° | 179.4° |
| C24 | C23 | C22 | H10 | 180.0° | 179.8° |
| C21 | C22 | C23 | H10 | 180.0° | 179.9° |
| C21 | C22 | C23 | H21 | 180.0° | 179.2° |
| C23 | C22 | C21 | H9 | 180.0° | 179.9° |
| C22 | C23 | C24 | H11 | 179.6° | 179.9° |
| H1 | C10 | C09 | H18 | 0.0° | 0.3° |
| H2 | C13 | H3 | H4 | 119.9° | 120.1° |
| H5 | C15 | C14 | H19 | 0.0° | 0.0° |
| H6 | C20 | H7 | H8 | 120.0° | 120.0° |
| H9 | C21 | C22 | H10 | 0.0° | 0.0° |
| H10 | C22 | C23 | H21 | 0.0° | 0.8° |
| H11 | C24 | C23 | H21 | 0.4° | 0.7° |
| H12 | C26 | C25 | H22 | 130.0° | 60.1° |
| H12 | C26 | C25 | H23 | 110.3° | 180.0° |
| H13 | C26 | C25 | H22 | 110.3° | 180.0° |
| H13 | C26 | C25 | H23 | 9.4° | 60.0° |
| H14 | C28 | H15 | H16 | 120.0° | 120.0° |
| H17 | C07 | C16 | H20 | 52.5° | 41.2° |
| H25 | C29 | H26 | H27 | 120.0° | 120.0° |
